SCHEMBL8184205

SCHEMBL8184205

Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2CCN(Cc2ccc(-c3cccnc3)cc2)Cc2ccc(-c3cccnc3)cc2)c1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 19/20 0.67
CYP3A4 P08684 1/20 0.50

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
SCHEMBL8184930 0.89 GNRHR (0.77) GNRHRCYP3A4
SCHEMBL8346371 0.87 GNRHR (0.76) GNRHRCYP3A4
SCHEMBL8184838 0.84 GNRHR (0.82) GNRHR
SCHEMBL8145820 0.82 GNRHR (0.92) GNRHR
SCHEMBL8030149 0.80 GNRHR (0.55) GNRHR
SCHEMBL6981337 0.79 GNRHR (1.00) GNRHR
Hydrochloric Acid SCHEMBL6983627 0.79 GNRHR (0.99) GNRHR
SCHEMBL6982908 0.79 GNRHR (0.71) GNRHR
SCHEMBL8182738 0.79 GNRHR (0.71) GNRHRCYP3A4
SCHEMBL8393418 0.79 GNRHR (0.61) GNRHRCYP3A4

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-6156772-A INDOLE HORMONE INHIBITORS MERCK & CO., INC. (US) 2000-12-05 US disclosed