SCHEMBL915030

SCHEMBL915030

CC(=O)c1ccc2c(c1)C1C=CCC1C(c1ccc(O)cc1)N2

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.78
KMT2A Q03164 6/20 0.78
ALDH1A1 P00352 5/20 0.78
MEN1 O00255 5/20 0.78
MAPT P10636 5/20 0.78
GAA P10253 4/20 0.78
POLB P06746 3/20 0.78
KDM4E B2RXH2 3/20 0.78
PKM P14618 1/20 0.78
RECQL P46063 1/20 0.78
LMNA P02545 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
USP7 Q93009 1/20 0.65
CA12 O43570 1/20 0.65
CA1 P00915 1/20 0.65
CA2 P00918 1/20 0.65
CA9 Q16790 1/20 0.65
L3MBTL1 Q9Y468 3/20 0.65
APOBEC3A P31941 2/20 0.65
APOBEC3G Q9HC16 2/20 0.65

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14582287 0.90 KMT2A (0.80) ARKMT2AALDH1A1MEN1MAPT
SCHEMBL914607 0.88 AR (0.81) ARKMT2AALDH1A1MEN1MAPT
SCHEMBL12700987 0.88 AR (0.74) ARKMT2AALDH1A1MEN1MAPT
SCHEMBL14129132 0.85 L3MBTL1 (0.72) ARKMT2AALDH1A1MEN1MAPT
SCHEMBL21105376 0.84 KMT2A (0.70) ARKMT2AALDH1A1MEN1MAPT
SCHEMBL917688 0.83 GPER1 (0.79) ARKMT2AALDH1A1MEN1MAPT
SCHEMBL20506682 0.83 GPER1 (0.79) ARKMT2AALDH1A1MEN1MAPT
SCHEMBL12700990 0.81 AR (0.65) ARKMT2AALDH1A1MEN1MAPT
SCHEMBL681674 0.80 MAPT (0.81) ARKMT2AALDH1A1MEN1MAPT
SCHEMBL21105585 0.80 GPER1 (0.71) ARKMT2AALDH1A1MEN1MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210186936-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY UNM RAINFOREST INNOVATIONS 2021-06-24 US disclosed
US-10980785-B2 Method for treating obesity, diabetes, cardiovascular and kidney diseases by regulating GPR30/GPER activity UNM RAINFOREST INNOVATIONS (US) 2021-04-20 US disclosed
US-10682341-B2 Method for treating obesity, diabetes, cardiovascular and kidney diseases by regulating GPR30/GPER activity STC.UNM (US) 2020-06-16 US disclosed
US-20200113875-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY UNM RAINFOREST INNOVATIONS 2020-04-16 US disclosed
US-10471047-B2 Method for treating obesity, diabetes, cardiovascular and kidney diseases by regulating GPR30/GPER activity STC.UNM (US) 2019-11-12 US disclosed
US-20190160047-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY UNM RAINFOREST INNOVATIONS 2019-05-30 US disclosed
US-10251870-B2 Method for treating obesity, diabetes, cardiovascular and kidney diseases by regulating GPR30/GPER activity STC.UNM (US) 2019-04-09 US disclosed
US-20180055826-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY UNM RAINFOREST INNOVATIONS 2018-03-01 US disclosed
US-20180055826-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY UNM RAINFOREST INNOVATIONS 2018-03-01 US disclosed
WO-2016144647-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY STC.UNM (US) 2016-09-15 WO disclosed
US-20110092533-A1 COMPOUNDS FOR BINDING TO ER ALPHA/BETA AND GPR30, METHODS OF TREATING DISEASE STATES AND CONDITIONS MEDIATED THROUGH THESE RECEPTORS AND IDENTIFICATION THEREOF STC. UNM (US) 2011-04-21 US disclosed
US-20110092533-A1 COMPOUNDS FOR BINDING TO ER ALPHA/BETA AND GPR30, METHODS OF TREATING DISEASE STATES AND CONDITIONS MEDIATED THROUGH THESE RECEPTORS AND IDENTIFICATION THEREOF STC. UNM (US) 2011-04-21 US disclosed
US-7875721-B2 Modulators of estrogen receptor alpha/beta G protein-coupled receptor 30, e.g., 1-(4-(6-Bromo-benzo[1,3]dioxol-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl)1-ethanone; treating diseases such as cancer, neurodegenerative disorders, obesity, osteoporosis, and symptoms of menopause STC.UNM (US) 2011-01-25 US disclosed
US-7875721-B2 Modulators of estrogen receptor alpha/beta G protein-coupled receptor 30, e.g., 1-(4-(6-Bromo-benzo[1,3]dioxol-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl)1-ethanone; treating diseases such as cancer, neurodegenerative disorders, obesity, osteoporosis, and symptoms of menopause STC.UNM (US) 2011-01-25 US disclosed
US-7875721-B2 Modulators of estrogen receptor alpha/beta G protein-coupled receptor 30, e.g., 1-(4-(6-Bromo-benzo[1,3]dioxol-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl)1-ethanone; treating diseases such as cancer, neurodegenerative disorders, obesity, osteoporosis, and symptoms of menopause STC.UNM (US) 2011-01-25 US disclosed
US-20080167334-A1 Compounds for binding to ERalpha/beta and GPR30, methods of treating disease states and conditions mediated through these receptors and identification thereof ARROWHEAD CENTER, INC. 2008-07-10 US disclosed
US-20080167334-A1 Compounds for binding to ERalpha/beta and GPR30, methods of treating disease states and conditions mediated through these receptors and identification thereof ARROWHEAD CENTER, INC. 2008-07-10 US disclosed
US-20080167334-A1 Compounds for binding to ERalpha/beta and GPR30, methods of treating disease states and conditions mediated through these receptors and identification thereof ARROWHEAD CENTER, INC. 2008-07-10 US disclosed
WO-2007019180-A2 COMPOUNDS FOR BINDING TO ERALPHA/BETA AND GPR30, METHODS OF TREATING DISEASE STATES AND CONDITIONS MEDIATED THROUGH THESE RECEPTORS AND IDENTIFICATION THEREOF SCIENCE & TECHNOLOGY CORPORATION @ UNM (US) 2007-02-15 WO disclosed
WO-2007019180-A2 COMPOUNDS FOR BINDING TO ERALPHA/BETA AND GPR30, METHODS OF TREATING DISEASE STATES AND CONDITIONS MEDIATED THROUGH THESE RECEPTORS AND IDENTIFICATION THEREOF SCIENCE & TECHNOLOGY CORPORATION @ UNM (US) 2007-02-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10682341-B2 Method for treating obesity, diabetes, cardiovascular and kidney diseases by regulating GPR30/GPER activity GPER1, NOX4, GPR119 AR 224/4885KMT2A 3431/4885ALDH1A1 1153/4885
US-20210186936-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY GPER1, NOX4, GPR119 AR 224/4885KMT2A 3431/4885ALDH1A1 1153/4885
US-20190160047-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY GPER1, NOX4, GPR119 AR 224/4885KMT2A 3431/4885ALDH1A1 1153/4885
US-20180055826-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY GPER1, NOX4, GPR119 AR 224/4885KMT2A 3431/4885ALDH1A1 1153/4885
US-10980785-B2 Method for treating obesity, diabetes, cardiovascular and kidney diseases by regulating GPR30/GPER activity GPER1, NOX4, GPR119 AR 224/4885KMT2A 3431/4885ALDH1A1 1153/4885
US-20110092533-A1 COMPOUNDS FOR BINDING TO ER ALPHA/BETA AND GPR30, METHODS OF TREATING DISEASE STATES AND CONDITIONS MEDIATED THROUGH THESE RECEPTORS AND IDENTIFICATION THEREOF GPER1, ESR2, ESRRG AR 49/4885KMT2A 4342/4885ALDH1A1 2014/4885
US-20080167334-A1 Compounds for binding to ERalpha/beta and GPR30, methods of treating disease states and conditions mediated through these receptors and identification thereof GPER1, ESR2, ESRRG AR 56/4885KMT2A 4138/4885ALDH1A1 1647/4885
US-10251870-B2 Method for treating obesity, diabetes, cardiovascular and kidney diseases by regulating GPR30/GPER activity GPER1, NOX4, GPR119 AR 224/4885KMT2A 3431/4885ALDH1A1 1153/4885
US-10471047-B2 Method for treating obesity, diabetes, cardiovascular and kidney diseases by regulating GPR30/GPER activity GPER1, NOX4, GPR119 AR 224/4885KMT2A 3431/4885ALDH1A1 1153/4885
US-20200113875-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY GPER1, NOX4, GPR119 AR 224/4885KMT2A 3431/4885ALDH1A1 1153/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.