SCHEMBL5311530

SCHEMBL5311530

COc1cccc(-c2c(C)nn(C(C)C)c(=O)c2CCc2cccc(F)c2)c1F

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 19/20 0.49
CASR P41180 1/20 0.39

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
SCHEMBL5311895 0.93 GNRHR (0.42) GNRHRCASR
SCHEMBL5311941 0.87 GNRHR (0.40) GNRHRCASR
SCHEMBL5308119 0.87 CASR (0.48) GNRHRCASR
SCHEMBL5310470 0.84 KDM4E (0.41) GNRHRCASR
SCHEMBL5308386 0.83 CASR (0.54) CASR
SCHEMBL5307986 0.83 CASR (0.45) GNRHRCASR
SCHEMBL5313086 0.82 GNRHR (0.40) GNRHRCASR
SCHEMBL5311056 0.82 GNRHR (0.46) GNRHR
SCHEMBL5310463 0.80 GNRHR (0.43) GNRHRCASR
SCHEMBL5311052 0.79 CASR (0.43) GNRHRCASR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007044796-A2 PYRIDAZINONE COMPOUNDS AS CALCILYTICS NPS PHARMACEUTICALS, INC. (US) 2007-04-19 WO disclosed
WO-2007044796-A2 PYRIDAZINONE COMPOUNDS AS CALCILYTICS NPS PHARMACEUTICALS, INC. (US) 2007-04-19 WO disclosed