SCHEMBL3019975

SCHEMBL3019975

CCN1CCCC1Oc1ccc(C2=C(c3ccccc3)CCc3cc(OC)ccc32)cc1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EBP Q15125 1/20 0.59
SIGMAR1 Q99720 1/20 0.59
ESR1 P03372 18/20 0.54

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
Hydrochloric Acid SCHEMBL8466620 0.99 EBP (0.58) EBPSIGMAR1ESR1
SCHEMBL8468620 0.85 EBP (0.41) EBPSIGMAR1ESR1
SCHEMBL8466831 0.81 MPO (0.46) EBPSIGMAR1
SCHEMBL11821605 0.79 ESR1 (0.72) EBPSIGMAR1ESR1
Hydrochloric Acid SCHEMBL8466618 0.79 SIGMAR1 (0.58) EBPSIGMAR1ESR1
SCHEMBL13109358 0.75 EBP (0.74) EBPSIGMAR1ESR1
SCHEMBL2817611 0.75 ESR1 (0.86) EBPSIGMAR1ESR1
Nafoxidine SCHEMBL10563464 0.75 EBP (1.00) EBPSIGMAR1ESR1
Nafoxidine SCHEMBL29494604 0.75 EBP (1.00) EBPSIGMAR1ESR1
Nafoxidine SCHEMBL153125 0.75 EBP (1.00) EBPSIGMAR1ESR1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5719136-A Combination of progesterone antagonists and antiestrogens with partial agonistic action for hormone substitution therapy for perimenopausal and postmenopausal women SCHERING AKTIENGESELLSCHAFT (DE) 1998-02-17 US claimed
EP-3515424-A1 ANTIESTROGENS AND/OR AROMATASE INHIBITORS FOR USE IN TREATING OBESITY AND RELATED SYMPTOMS Repros Therapeutics Inc. (US) 2019-07-31 EP disclosed
WO-2018058032-A1 ANTIESTROGENS AND/OR AROMATASE INHIBITORS FOR USE IN TREATING OBESITY AND RELATED SYMPTOMS REPROS THERAPEUTICS INC. (US) 2018-03-29 WO disclosed
EP-2819676-A1 COMBINATION THERAPY FOR TREATING ANDROGEN DEFICIENCY Repros Therapeutics Inc. (US) 2015-01-07 EP disclosed
WO-2013130832-A1 COMBINATION THERAPY FOR TREATING ANDROGEN DEFICIENCY REPROS THERAPEUTICS INC. (US) 2013-09-06 WO disclosed
EP-2211848-A1 TRANS-CLOMIPHENE FOR METABOLIC SYNDROME Repros Therapeutics Inc. (US) 2010-08-04 EP disclosed
WO-2009051908-A1 TRANS-CLOMIPHENE FOR METABOLIC SYNDROME REPROS THERAPEUTICS INC. (US) 2009-04-23 WO disclosed