SCHEMBL7908416

SCHEMBL7908416

CCOC(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCNCCCCc3ccc(NS(C)(=O)=O)cc3)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 1/20 0.69

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
SCHEMBL8695101 0.90 GNRHR (0.78) GNRHR
SCHEMBL8691284 0.88
SCHEMBL7899418 0.88 GNRHR (0.78) GNRHR
SCHEMBL7912405 0.87
SCHEMBL7997217 0.87 GNRHR (0.72) GNRHR
SCHEMBL8693238 0.85 GNRHR (0.73) GNRHR
SCHEMBL8694589 0.84 GNRHR (0.52) GNRHR
SCHEMBL6980604 0.84 GNRHR (0.82) GNRHR
SCHEMBL7912387 0.83 GNRHR (0.51) GNRHR
SCHEMBL7905608 0.83 GNRHR (0.82) 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