SCHEMBL4428197

SCHEMBL4428197

O=C1CCCc2cc(-c3cccc(F)c3)ccc21

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.61
PARP11 Q9NR21 1/20 0.61
HSD17B1 P14061 4/20 0.60
MAOA P21397 7/20 0.56
MAOB P27338 7/20 0.56
HRH3 Q9Y5N1 1/20 0.53
PRKCI P41743 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP11B1 P15538 1/20 0.49
CYP11B2 P19099 1/20 0.49
MAPK14 Q16539 3/20 0.47
CYP2A6 P11509 1/20 0.47
GRM5 P41594 1/20 0.47
PGR P06401 1/20 0.45
FFAR4 Q5NUL3 1/20 0.43

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
SCHEMBL16821225 0.88 PARP10 (0.50) PARP10PARP11HSD17B1MAOAMAOB
SCHEMBL7506302 0.85 HSD17B1 (0.71) HSD17B1MAOAMAOBHRH3PRKCI
SCHEMBL7584101 0.83 HSD17B1 (0.73) PARP10PARP11HSD17B1MAOAMAOB
SCHEMBL315877 0.81 MAOA (0.61) HSD17B1MAOAMAOBPRKCIMAPK14
SCHEMBL4563338 0.81 PARP10 (0.61) PARP10PARP11HSD17B1MAOAMAOB
SCHEMBL7509673 0.81 HSD17B1 (0.56) PARP10PARP11HSD17B1MAOAMAOB
SCHEMBL4424565 0.81 PARP10 (0.61) PARP10PARP11HSD17B1MAOAMAOB
SCHEMBL3021186 0.81 HSD17B1 (0.74) HSD17B1MAOAMAOBPRKCICYP1A2
SCHEMBL7507475 0.81 HSD17B1 (0.56) PARP10PARP11HSD17B1MAOAMAOB
SCHEMBL4416659 0.81 HSD17B1 (0.64) HSD17B1MAOAMAOBHRH3PRKCI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230286917-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2023-09-14 US disclosed
US-20230286917-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2023-09-14 US disclosed
US-11639333-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC (US) 2023-05-02 US disclosed
US-11639333-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC (US) 2023-05-02 US disclosed
US-11214542-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2022-01-04 US disclosed
US-20210009520-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2021-01-14 US disclosed
US-10807956-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2020-10-20 US disclosed
US-20200172485-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2020-06-04 US disclosed
US-10597365-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2020-03-24 US disclosed
US-20190077758-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2019-03-14 US disclosed
US-8952151-B2 Histone demethylase inhibitors Quanticel Pharmaceuticals, Inc. (US) 2015-02-10 US disclosed
US-8952151-B2 Histone demethylase inhibitors Quanticel Pharmaceuticals, Inc. (US) 2015-02-10 US disclosed
US-20140213591-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-07-31 US disclosed
US-20140213591-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-07-31 US disclosed
WO-2014100818-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-06-26 WO disclosed
US-20090325916-A1 5-ARYL INDAN-1-ONE AND ANALOGS USEFUL AS PROGESTERONE RECEPTOR MODULATORS WYETH (US) 2009-12-31 US disclosed
US-20080119537-A1 5-Aryl indan-1 one and analogs useful as progesterone receptor modulators WYETH (US) 2008-05-22 US disclosed
US-7319152-B2 Contraception, hormone replacement therapy, cycle-related symptoms, or benign or malignant neoplastic disease; -methyl-5-(5-oxo-5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrrole-2-carbonitrile WYETH (US) 2008-01-15 US disclosed
US-20070066628-A1 5-Aryl-indan-1-ol and analogs useful as progesterone receptor modulators WYETH (US) 2007-03-22 US disclosed
US-20070066675-A1 5-Aryl-indan-1-one and analogs useful as progesterone receptor modulators WYETH (US) 2007-03-22 US 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 (13 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-20190077758-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A PARP10 730/4885PARP11 508/4885HSD17B1 1528/4885
US-11214542-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM1A PARP10 730/4885PARP11 508/4885HSD17B1 1528/4885
US-20070066628-A1 5-Aryl-indan-1-ol and analogs useful as progesterone receptor modulators PGR, CYP19A1, GNRHR PARP10 668/4885PARP11 1070/4885HSD17B1 113/4885
US-20070066675-A1 5-Aryl-indan-1-one and analogs useful as progesterone receptor modulators PGR, CYP19A1, GNRHR PARP10 1176/4885PARP11 1124/4885HSD17B1 146/4885
US-10807956-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM1A PARP10 730/4885PARP11 508/4885HSD17B1 1528/4885
US-20090325916-A1 5-ARYL INDAN-1-ONE AND ANALOGS USEFUL AS PROGESTERONE RECEPTOR MODULATORS CYP19A1, PGR, NR5A1 PARP10 2334/4885PARP11 1709/4885HSD17B1 58/4885
US-20230286917-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A PARP10 730/4885PARP11 508/4885HSD17B1 1528/4885
US-20210009520-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A PARP10 730/4885PARP11 508/4885HSD17B1 1528/4885
US-11639333-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM1A PARP10 730/4885PARP11 508/4885HSD17B1 1528/4885
US-20080119537-A1 5-Aryl indan-1 one and analogs useful as progesterone receptor modulators CYP19A1, PGR, NR5A1 PARP10 1904/4885PARP11 1253/4885HSD17B1 64/4885
US-20200172485-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A PARP10 730/4885PARP11 508/4885HSD17B1 1528/4885
US-20140213591-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A PARP10 730/4885PARP11 508/4885HSD17B1 1528/4885
US-10597365-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM1A PARP10 730/4885PARP11 508/4885HSD17B1 1528/4885

“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.