SCHEMBL8523249

SCHEMBL8523249

Cc1cc(C)cc(-c2[nH]c3ccc(C(=O)O)cc3c2CCNCC(CCc2ccc(NS(C)(=O)=O)cc2)C(=O)OCc2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 1/20 0.56

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
SCHEMBL8692395 0.87 GNRHR (0.48) GNRHR
SCHEMBL8694427 0.86 GNRHR (0.56) GNRHR
SCHEMBL8694430 0.86 GNRHR (0.57) GNRHR
SCHEMBL8692391 0.84 GNRHR (0.43) GNRHR
SCHEMBL8692386 0.83 GNRHR (0.44) GNRHR
SCHEMBL7899439 0.81 GNRHR (0.55) GNRHR
SCHEMBL8689841 0.81 GNRHR (0.54) GNRHR
SCHEMBL8689844 0.80 GNRHR (0.55) GNRHR
SCHEMBL8692401 0.78 GNRHR (0.56) GNRHR
SCHEMBL8689540 0.78

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882040-A4 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO INC (US) 1999-02-10 EP disclosed
EP-0882040-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE Merck & Co., Inc. (US) 1998-12-09 EP disclosed
WO-1997021707-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO., INC. (US) 1997-06-19 WO disclosed