SCHEMBL8699466

SCHEMBL8699466

Cc1cc(C)cc(-c2[nH]c3ccc(-n4nn[nH]c4=O)cc3c2CCNCC(CCc2cccnc2)Cc2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 10/20 0.49

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
SCHEMBL8694469 0.90 GNRHR (0.52) GNRHR
SCHEMBL8698046 0.85 GNRHR (0.54) GNRHR
SCHEMBL6982762 0.79 GNRHR (0.49) GNRHR
SCHEMBL8699468 0.78 GNRHR (0.48) GNRHR
SCHEMBL7905321 0.76 GNRHR (0.65) GNRHR
SCHEMBL8694472 0.73 GNRHR (0.52) GNRHR
SCHEMBL6983848 0.69 GNRHR (0.57) GNRHR
SCHEMBL6985661 0.68 GNRHR (0.49) GNRHR
SCHEMBL6983842 0.67 GNRHR (0.60) GNRHR
SCHEMBL8698055 0.66 GNRHR (0.54) 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-5780437-A ADMINISTERING TO TREAT SEX-HORMONE RELATED DISORDERS MERCK & CO., INC. (US) 1998-07-14 US disclosed