SCHEMBL28777976

SCHEMBL28777976

Cc1nc(-c2cccc(F)c2Cc2ccccc2)n(CCc2ccccc2)c(=O)c1Br

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CASR P41180 19/20 0.68
NR1I2 O75469 5/20 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
SCHEMBL27751206 0.87 CASR (0.68) CASRNR1I2
SCHEMBL4143340 0.86 CASR (0.76) CASRNR1I2
SCHEMBL28774588 0.85 CASR (0.57) CASRNR1I2
SCHEMBL27751132 0.85 CASR (0.64) CASRNR1I2
SCHEMBL28777900 0.85 CASR (0.50) CASRNR1I2
SCHEMBL4142983 0.84 CASR (0.56) CASRNR1I2
SCHEMBL27730770 0.83 CASR (0.59) CASRNR1I2
SCHEMBL3351066 0.82 CASR (0.54) CASRNR1I2
SCHEMBL4161402 0.82 CASR (0.67) CASRNR1I2
SCHEMBL4147429 0.81 CASR (1.00) CASRNR1I2

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
CN-101360498-A Calcilytic compounds SMITHKLINE BEECHAM CORP (US) 2009-02-04 CN disclosed