SCHEMBL7899369

SCHEMBL7899369

Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)O)cc3c2CCN(CCCCc2ccc(NS(C)(=O)=O)cc2)C(=O)OCc2ccccc2)c1

nearest known ligand 0.65

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
SCHEMBL7912387 0.94 GNRHR (0.51) GNRHR
SCHEMBL7899397 0.91 GNRHR (0.55) GNRHR
SCHEMBL7899439 0.90 GNRHR (0.55) GNRHR
SCHEMBL8692405 0.90 GNRHR (0.55) GNRHR
SCHEMBL7908754 0.88 GNRHR (0.53) GNRHR
SCHEMBL7899411 0.87 GNRHR (0.52) GNRHR
SCHEMBL6974859 0.85 GNRHR (0.61) GNRHR
SCHEMBL8690027 0.84 GNRHR (0.54) GNRHR
SCHEMBL7907209 0.82 GNRHR (0.54) GNRHR
SCHEMBL6978236 0.80 GNRHR (0.60) GNRHR

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