SCHEMBL1881237

SCHEMBL1881237

CC/C(=C(\c1ccc(F)cc1)c1ccc(/C=C/C(=O)O)cc1)c1ccccc1

nearest known ligand 0.87

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 20/20 0.87
ESR2 Q92731 3/20 0.87
PGR P06401 2/20 0.87

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
SCHEMBL1881240 1.00 ESR1 (0.87) ESR1ESR2PGR
SCHEMBL3813473 0.96 ESR1 (0.79) ESR1ESR2PGR
SCHEMBL3813467 0.96 ESR1 (0.79) ESR1ESR2PGR
SCHEMBL667262 0.93 ESR1 (1.00) ESR1ESR2PGR
SCHEMBL6903749 0.93 ESR1 (1.00) ESR1ESR2PGR
SCHEMBL407673 0.93 ESR1 (1.00) ESR1ESR2PGR
SCHEMBL407674 0.93 ESR1 (1.00) ESR1ESR2PGR
SCHEMBL5070365 0.88 ESR1 (1.00) ESR1ESR2PGR
SCHEMBL5070367 0.88 ESR1 (1.00) ESR1ESR2PGR
SCHEMBL21512474 0.88 ESR1 (1.00) ESR1ESR2PGR

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-20150320739-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II BAUSCH HEALTH IRELAND LIMITED (F/K/A/ VALEANT PHARMACEUTICALS IRELAND LIMITED) (IE) 2015-11-12 US claimed
US-20130203766-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II SPROUT PHARMACEUTICALS, INC. (US) 2013-08-08 US claimed
US-20110105519-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II SPROUT PHARMACEUTICALS, INC. 2011-05-05 US claimed
US-20080103155-A1 Pharmaceutical compositions for the treatment of sexual disorders II SPROUT PHARMACEUTICALS, INC. 2008-05-01 US claimed
EP-1740181-A1 NEW PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF SEXUAL DISORDERS II BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-01-10 EP claimed
US-20050245539-A1 Pharmaceutical compositions for the treatment of sexual disorders II BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-03 US claimed
WO-2005102342-A1 NEW PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF SEXUAL DISORDERS II BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-03 WO claimed
EP-1268389-B1 HALOGENATED TRIPHENYLETHYLENE DERIVATIVES AS SELECTIVE ESTROGEN RECEPTOR MODULATORS BRISTOL MYERS SQUIBB PHARMA CO (US) 2004-09-22 EP claimed
US-20040044080-A1 Treatment of dyspareunia with topically administered nitroglycerin formulations VIVUS, INC. 2004-03-04 US claimed
US-6528681-B2 3-(4-(1-(4-fluorophenyl)-2-phenyl-but-1-enyl)phenyl)acrlic acid for example; for treatment and/or prevention of breast, uterine, ovarian, prostrate and colon cancer, osteoporosis, cardiovascular disease, and benign proliferative disorders BRISTOL-MEYERS SQUIBB PHARMA COMPANY 2003-03-04 US claimed
US-20020013297-A1 Halogenated triphenylethylene derivatives as selective estrogen receptor modulators BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-01-31 US claimed
US-20150320739-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II BAUSCH HEALTH IRELAND LIMITED (F/K/A/ VALEANT PHARMACEUTICALS IRELAND LIMITED) (IE) 2015-11-12 US disclosed
US-20130203766-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II SPROUT PHARMACEUTICALS, INC. (US) 2013-08-08 US disclosed
US-20110105519-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II SPROUT PHARMACEUTICALS, INC. 2011-05-05 US disclosed
US-20080103155-A1 Pharmaceutical compositions for the treatment of sexual disorders II SPROUT PHARMACEUTICALS, INC. 2008-05-01 US disclosed
US-20050245539-A1 Pharmaceutical compositions for the treatment of sexual disorders II BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-03 US disclosed
EP-1268389-B1 HALOGENATED TRIPHENYLETHYLENE DERIVATIVES AS SELECTIVE ESTROGEN RECEPTOR MODULATORS BRISTOL MYERS SQUIBB PHARMA CO (US) 2004-09-22 EP disclosed
US-20040044080-A1 Treatment of dyspareunia with topically administered nitroglycerin formulations VIVUS, INC. 2004-03-04 US disclosed
US-6528681-B2 3-(4-(1-(4-fluorophenyl)-2-phenyl-but-1-enyl)phenyl)acrlic acid for example; for treatment and/or prevention of breast, uterine, ovarian, prostrate and colon cancer, osteoporosis, cardiovascular disease, and benign proliferative disorders BRISTOL-MEYERS SQUIBB PHARMA COMPANY 2003-03-04 US disclosed
US-20020013297-A1 Halogenated triphenylethylene derivatives as selective estrogen receptor modulators BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-01-31 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 (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-20080103155-A1 Pharmaceutical compositions for the treatment of sexual disorders II FLNB, FLNA, FGB ESR1 303/4885ESR2 616/4885PGR 408/4885
US-20020013297-A1 Halogenated triphenylethylene derivatives as selective estrogen receptor modulators GPER1, ESR1, PTGER1 ESR1 2/4885ESR2 11/4885PGR 10/4885
US-20130203766-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB ESR1 303/4885ESR2 616/4885PGR 408/4885
US-20110105519-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB ESR1 303/4885ESR2 616/4885PGR 408/4885
US-20150320739-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB ESR1 303/4885ESR2 616/4885PGR 408/4885
US-20040044080-A1 Treatment of dyspareunia with topically administered nitroglycerin formulations PDE12, PDE3A, PDE2A ESR1 76/4885ESR2 122/4885PGR 116/4885
US-20050245539-A1 Pharmaceutical compositions for the treatment of sexual disorders II FLNB, FLNA, FGB ESR1 303/4885ESR2 616/4885PGR 408/4885

“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.