SCHEMBL8694302

SCHEMBL8694302

Cc1cc(C)cc(-c2[nH]c3ccccc3c2CCC(N)CCCc2ccc(O)cc2)c1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 1/20 0.68

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
SCHEMBL8692751 0.87 GNRHR (0.67) GNRHR
SCHEMBL8002899 0.81 GNRHR (1.00) GNRHR
SCHEMBL7995735 0.79 GNRHR (0.84) GNRHR
SCHEMBL8692594 0.75 GNRHR (0.56) GNRHR
SCHEMBL7995810 0.74 GNRHR (0.54) GNRHR
SCHEMBL8689734 0.71 GNRHR (0.49) GNRHR
SCHEMBL7912408 0.69 CYP1A2 (0.66) GNRHR
SCHEMBL8693234 0.69 GNRHR (0.53) GNRHR
SCHEMBL7997233 0.68 GNRHR (0.50) GNRHR
SCHEMBL8693230 0.68 GNRHR (0.55) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5756507-A TREATING SEX HORMONE RELATED DISORDERS MERCK & CO., INC. (US) 1998-05-26 US disclosed