SCHEMBL119668

SCHEMBL119668

CCC(=O)OC1(C)CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.51
OPRM1 P35372 3/20 0.33
OPRD1 P41143 3/20 0.33
OPRK1 P41145 3/20 0.33
LMNA P02545 2/20 0.33
FFAR3 O14843 1/20 0.32
CYP2C19 P33261 2/20 0.32
ALDH1A1 P00352 1/20 0.31
KDM4E B2RXH2 3/20 0.30

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
SCHEMBL9912807 1.00 CYP19A1 (0.51) CYP19A1OPRM1OPRD1OPRK1LMNA
SCHEMBL118423 0.98 CYP19A1 (0.49) CYP19A1OPRM1OPRD1OPRK1LMNA
SCHEMBL28169858 0.93 CYP19A1 (0.45) CYP19A1OPRM1OPRD1OPRK1LMNA
SCHEMBL13947948 0.89
SCHEMBL12332525 0.87 CYP19A1 (0.45) CYP19A1CYP2C19ALDH1A1KDM4E
SCHEMBL25397835 0.84 CYP19A1 (0.53) CYP19A1LMNACYP2C19
SCHEMBL10192990 0.84 CYP19A1 (0.43) CYP19A1LMNACYP2C19ALDH1A1
SCHEMBL14478384 0.83 CYP19A1 (0.49) CYP19A1LMNAFFAR3CYP2C19ALDH1A1
SCHEMBL5702559 0.83 CYP19A1 (0.56) CYP19A1CYP2C19
SCHEMBL5702555 0.83 CYP19A1 (0.51) CYP19A1CYP2C19

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 85 patents — showing the first 20. 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
WO-2005102342-A1 NEW PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF SEXUAL DISORDERS II BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-03 WO claimed
US-20050245539-A1 Pharmaceutical compositions for the treatment of sexual disorders II BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-03 US claimed
US-11914294-B2 Positive resist composition and pattern forming process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-02-27 US disclosed
US-20240027902-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-01-25 US disclosed
US-20240027909-A1 POSITIVE RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-01-25 US disclosed
US-11860540-B2 Positive resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-01-02 US disclosed
EP-4282885-A1 ACTINIC-RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, ACTINIC-RAY-SENSITIVE OR RADIATION-SENSITIVE FILM, METHOD FOR FORMING PATTERN, AND METHOD FOR PRODUCING ELECTRONIC DEVICE FUJIFILM Corporation (JP) 2023-11-29 EP disclosed
US-20230367210-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE FILM, PATTERN FORMING METHOD, AND METHOD FOR MANUFACTURING ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2023-11-16 US disclosed
US-20040106808-A1 Processes for preparing calanolide a and intermediates thereof SAGAMI CHEMICAL RESEARCH CENTER (JP) 2004-06-03 US disclosed
US-20040044080-A1 Treatment of dyspareunia with topically administered nitroglycerin formulations VIVUS, INC. 2004-03-04 US disclosed
EP-1352907-A1 PROCESSES FOR PREPARING CALANOLIDE A AND INTERMEDIATES THEREOF KURARAY CO., LTD. (JP) 2003-10-15 EP disclosed
CN-1092649-C Thiazolidinone compound or angina pectoris therapeutic or prophylactic agent containing the same as active ingredient SANKYO CO (JP) 2002-10-16 CN disclosed
EP-0837845-A1 HERPES RIBONUCLEOTIDE REDUCTASE INHIBITORS BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 1998-04-29 EP disclosed
CN-1175250-A Thiazolidinone compound or angina pectoris therapeutic or prophylactic agent containing the same as active ingredient SANKYO CO (JP) 1998-03-04 CN disclosed
WO-1997000855-A1 HERPES RIBONUCLEOTIDE REDUCTASE INHIBITORS BOEHRINGER INGELHEIM (CANADA) LTD./BOEHRINGER INGELHEIM (CANADA) LTÉE. (CA) 1997-01-09 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-20040106808-A1 Processes for preparing calanolide a and intermediates thereof CALR, CYP51A1, CYP4A11 CYP19A1 26/4885OPRM1 4662/4885OPRD1 3695/4885
US-20080103155-A1 Pharmaceutical compositions for the treatment of sexual disorders II FLNB, FLNA, FGB CYP19A1 7/4885OPRM1 1673/4885OPRD1 593/4885
US-20130203766-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB CYP19A1 7/4885OPRM1 1673/4885OPRD1 593/4885
US-20110105519-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB CYP19A1 7/4885OPRM1 1673/4885OPRD1 593/4885
US-20150320739-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB CYP19A1 7/4885OPRM1 1673/4885OPRD1 593/4885
US-20040044080-A1 Treatment of dyspareunia with topically administered nitroglycerin formulations PDE12, PDE3A, PDE2A CYP19A1 11/4885OPRM1 251/4885OPRD1 665/4885
US-20050245539-A1 Pharmaceutical compositions for the treatment of sexual disorders II FLNB, FLNA, FGB CYP19A1 7/4885OPRM1 1673/4885OPRD1 593/4885

“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.