SCHEMBL7908754

SCHEMBL7908754

CCOC(=O)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN(CCCCc3ccc(NS(C)(=O)=O)cc3)C(=O)OCc3ccccc3)c2c1

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 1/20 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
SCHEMBL7899439 0.94 GNRHR (0.55) GNRHR
SCHEMBL8692405 0.90 GNRHR (0.55) GNRHR
SCHEMBL7912387 0.89 GNRHR (0.51) GNRHR
SCHEMBL7899369 0.88 GNRHR (0.53) GNRHR
SCHEMBL6982311 0.87 GNRHR (0.61) GNRHR
SCHEMBL7899411 0.87 GNRHR (0.52) GNRHR
SCHEMBL7899397 0.85 GNRHR (0.55) GNRHR
SCHEMBL8689841 0.84 GNRHR (0.54) GNRHR
SCHEMBL7543850 0.83 GNRHR (0.50) GNRHR
SCHEMBL7912405 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6197975-B1 7-AZABICYCLO(2.2.1)HEPTANE-7-CARBONYL-SUBSTITUTED 2-PHENYLINDOLE DERIVATIVES; SEXUAL DISORDERS; ANTICARCINOGENIC AGENTS MERCK & CO. , INC. 2001-03-06 US disclosed
US-5756507-A TREATING SEX HORMONE RELATED DISORDERS MERCK & CO., INC. (US) 1998-05-26 US disclosed