SCHEMBL916163

SCHEMBL916163

CC(=O)c1ccc2c(c1)C1C=CCC1C(c1cc3c(cc1-c1ccccc1)OCO3)N2

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 4/20 0.75
▸ GPER1 Q99527 3/20 0.75
▸ GPR183 P32249 1/20 0.75
▸ NPC1 O15118 1/20 0.75
▸ RAB9A P51151 1/20 0.75
▸ KMT2A Q03164 7/20 0.58
▸ ALDH1A1 P00352 5/20 0.58
▸ POLB P06746 4/20 0.58
▸ GAA P10253 4/20 0.58
▸ APOBEC3A P31941 2/20 0.58
▸ APOBEC3G Q9HC16 2/20 0.58
▸ MASP2 O00187 1/20 0.58
▸ USP2 O75604 1/20 0.58
▸ NSD2 O96028 1/20 0.58
▸ ALPL P05186 1/20 0.58
▸ MCL1 Q07820 1/20 0.58
▸ MAPT P10636 7/20 0.56
▸ MEN1 O00255 6/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ PKM P14618 1/20 0.56

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
SCHEMBL19911647 0.87 GPER1 (0.58) L3MBTL1GPER1GPR183NPC1RAB9A
SCHEMBL12700921 0.86 GPER1 (1.00) L3MBTL1GPER1GPR183NPC1RAB9A
SCHEMBL31006405 0.86 GPER1 (1.00) L3MBTL1GPER1GPR183NPC1RAB9A
SCHEMBL30657722 0.86 GPER1 (1.00) L3MBTL1GPER1GPR183NPC1RAB9A
SCHEMBL12700947 0.86 GPER1 (1.00) L3MBTL1GPER1GPR183NPC1RAB9A
SCHEMBL12524898 0.86 GPER1 (1.00) L3MBTL1GPER1GPR183NPC1RAB9A
SCHEMBL12700948 0.86 GPER1 (1.00) L3MBTL1GPER1GPR183NPC1RAB9A
SCHEMBL12700922 0.86 GPER1 (1.00) L3MBTL1GPER1GPR183NPC1RAB9A
SCHEMBL12700983 0.86 GPER1 (1.00) L3MBTL1GPER1GPR183NPC1RAB9A
SCHEMBL30569761 0.86 GPER1 (1.00) L3MBTL1GPER1GPR183NPC1RAB9A

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 20 patents. 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-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-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-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-8487100-B2 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) 2013-07-16 — — US disclosed
US-8487100-B2 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) 2013-07-16 — — US disclosed
US-8487100-B2 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) 2013-07-16 — — 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-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 (7 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 L3MBTL1 4808/4885GPER1 1/4885GPR183 33/4885
US-20210186936-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY GPER1, NOX4, GPR119 L3MBTL1 4808/4885GPER1 1/4885GPR183 33/4885
US-20190160047-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY GPER1, NOX4, GPR119 L3MBTL1 4808/4885GPER1 1/4885GPR183 33/4885
US-20180055826-A1 METHOD FOR TREATING OBESITY, DIABETES, CARDIOVASCULAR AND KIDNEY DISEASES BY REGULATING GPR30/GPER ACTIVITY GPER1, NOX4, GPR119 L3MBTL1 4808/4885GPER1 1/4885GPR183 33/4885
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 L3MBTL1 4018/4885GPER1 1/4885GPR183 61/4885
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 L3MBTL1 3985/4885GPER1 1/4885GPR183 83/4885
US-10471047-B2 Method for treating obesity, diabetes, cardiovascular and kidney diseases by regulating GPR30/GPER activity GPER1, NOX4, GPR119 L3MBTL1 4808/4885GPER1 1/4885GPR183 33/4885

“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.

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