SCHEMBL7995735

SCHEMBL7995735

Cc1cc(C)cc(-c2[nH]c3ccccc3c2CNCCCCc2ccc(O)cc2)c1

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 1/20 0.84

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
SCHEMBL8002899 0.92 GNRHR (1.00) GNRHR
SCHEMBL8694302 0.79 GNRHR (0.68) GNRHR
SCHEMBL8692751 0.78 GNRHR (0.67) GNRHR
SCHEMBL7912503 0.77 GNRHR (0.72) GNRHR
SCHEMBL7912330 0.73 GNRHR (0.67) GNRHR
SCHEMBL8690295 0.73
SCHEMBL8689611 0.72
SCHEMBL7905635 0.72 GNRHR (0.64) GNRHR
SCHEMBL8693230 0.71 GNRHR (0.55) GNRHR
SCHEMBL8692594 0.70 GNRHR (0.56) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0868178-A4 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO INC (US) 2000-03-29 EP disclosed
EP-0868178-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE Merck & Co., Inc. (US) 1998-10-07 EP disclosed
US-5756507-A TREATING SEX HORMONE RELATED DISORDERS MERCK & CO., INC. (US) 1998-05-26 US disclosed
WO-1997021435-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO., INC. (US) 1997-06-19 WO disclosed