SCHEMBL514373

SCHEMBL514373

C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@]13CC[C@]2(O)CC3

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.53
ESR2 Q92731 7/20 0.53
SHBG P04278 5/20 0.53
STS P08842 4/20 0.53
HSD17B10 Q99714 4/20 0.53
LMNA P02545 4/20 0.53
PGR P06401 4/20 0.53
CYP3A4 P08684 4/20 0.53
AR P10275 4/20 0.53
SLC6A4 P31645 4/20 0.53
SLC6A3 Q01959 4/20 0.53
SERPINA6 P08185 3/20 0.53
SNCA P37840 3/20 0.53
HTR2B P41595 3/20 0.53
HIF1A Q16665 3/20 0.53
AKR1B10 O60218 2/20 0.53
CYP1A2 P05177 2/20 0.53
MAPT P10636 2/20 0.53
AKR1B1 P15121 2/20 0.53
BLM P54132 2/20 0.53

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
SCHEMBL8959369 1.00 ESR1 (0.53) ESR1ESR2SHBGSTSHSD17B10
SCHEMBL29500480 1.00 ESR1 (0.53) ESR1ESR2SHBGSTSHSD17B10
SCHEMBL8938727 0.95 SHBG (0.50) ESR1ESR2SHBGSTSHSD17B10
Benzoic Acid SCHEMBL9628348 0.89 STS (0.47) ESR1ESR2SHBGSTSHSD17B10
SCHEMBL9627672 0.85 LMNA (0.55) ESR1ESR2STSHSD17B10LMNA
SCHEMBL8959365 0.83 ESR1 (0.52) ESR1ESR2SHBGSTSHSD17B10
SCHEMBL8959381 0.83 ESR1 (0.52) ESR1ESR2SHBGSTSHSD17B10
SCHEMBL9146993 0.83 ESR1 (0.52) ESR1ESR2SHBGSTSHSD17B10
SCHEMBL259537 0.83 ESR1 (0.52) ESR1ESR2SHBGSTSHSD17B10
SCHEMBL9725182 0.82 ESR1 (0.48) ESR1ESR2SHBGSTSHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0655916-B1 TRANSDERMAL APPLICATION AGENT CONTAINING 3-KETO-DESOGESTREL SCHERING AG (DE) 1998-02-04 EP claimed
EP-0318490-B1 14,17-G(B)-ETHANO-14-G(B)-ESTRATRIENES, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL PREPARATIONS CONTAINING THESE SCHERING AKTIENGESELLSCHAFT (DE) 1992-01-29 EP claimed
US-4789671-A ESTROGENIC ACTIVITY SCHERING AKTIENGESELLSCHAFT (DE) 1988-12-06 US claimed
US-9132101-B2 Administration form based on cross-linked hydrophilic polymers LTS LOHMANN THERAPIE-SYSTEME AG (DE) 2015-09-15 US disclosed
US-20130225542-A1 Therapeutic Gestagens For The Treatment Of Premenstrual Dysphoric Disorder SCHERING AKITIENGESELLSCHAFT (DE) 2013-08-29 US disclosed
US-20120225853-A1 HORMONE REPLACEMENT THERAPY AND DEPRESSION Bayer Pharma AG (DE) 2012-09-06 US disclosed
US-20120028935-A1 Therapeutic Gestagens for the Treatment of Premenstrual Dysphoric Disorder FOEGH MARIE (US) 2012-02-02 US disclosed
US-20090137537-A1 THERAPEUTIC GESTAGENS FOR THE TREATMENT OF PREMENSTRUAL DYSPHORIC DISORDER FOEGH MARIE 2009-05-28 US disclosed
EP-1635843-B1 THERAPY COMPRISING DIENOGEST FOR HORMONE REPLACEMENT AND DEPRESSION BAYER SCHERING PHARMA AG (DE) 2009-01-07 EP disclosed
US-20070111974-A1 Therapeutic gestagens for the treatment of premenstrual dysphoric disorder BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-05-17 US disclosed
US-20070071796-A1 Administration form based on cross-linked hydrophilic polymers LTS LOHMANN THERAPIE-SYSTEME AG (DE) 2007-03-29 US disclosed
EP-0664811-B1 GESTAGENICALLY ACTIVE 19,11-BRIDGED 4-ESTRENES SCHERING AG (DE) 1997-08-13 EP disclosed
EP-0513947-B1 14 Alpha, 16alpha-ethano- and 14alpha, 16alpha ethenoestratrienes SCHERING AG (DE) 1995-11-15 EP disclosed
US-5439902-A Estrogen therapy, birth control SCHERING AKTIENGESELLSCHAFT (DE) 1995-08-08 US disclosed
EP-0513947-A1 14 Alpha, 16alpha-ethano- and 14alpha, 16alpha ethenoestratrienes SCHERING AKTIENGESELLSCHAFT (DE) 1992-11-19 EP disclosed
WO-1992019641-A1 14α,16α-ETHANO AND 14α,16α-ETHENO ESTRATRIENES SCHERING AKTIENGESELLSCHAFT BERLIN UND BERGKAMEN (DE) 1992-11-12 WO disclosed
US-5134136-A Estrogenic agents SCHERING AKTIENGESELLSCHAFT (DE) 1992-07-28 US disclosed
EP-0318490-B1 14,17-G(B)-ETHANO-14-G(B)-ESTRATRIENES, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL PREPARATIONS CONTAINING THESE SCHERING AKTIENGESELLSCHAFT (DE) 1992-01-29 EP disclosed
EP-0372665-A1 14-Alpha, 17-alpha-ethane estratrienes SCHERING AKTIENGESELLSCHAFT (DE) 1990-06-13 EP disclosed
US-4789671-A ESTROGENIC ACTIVITY SCHERING AKTIENGESELLSCHAFT (DE) 1988-12-06 US disclosed