SCHEMBL13614362

SCHEMBL13614362

CC(C)CNCc1ccc2c(c1)CCC[C@@H]2n1cc(C[C@@H]2C(=O)NC=CN2S(=O)(=O)c2ccccc2)nn1

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 20/20 0.48

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
SCHEMBL4335056 1.00 BDKRB1 (0.48) BDKRB1
SCHEMBL4335050 1.00 BDKRB1 (0.48) BDKRB1
SCHEMBL4338634 0.95 BDKRB1 (0.55) BDKRB1
SCHEMBL13614358 0.95 BDKRB1 (0.55) BDKRB1
SCHEMBL4338630 0.95 BDKRB1 (0.55) BDKRB1
SCHEMBL4336176 0.94 BDKRB1 (0.48) BDKRB1
SCHEMBL13614368 0.94 BDKRB1 (0.48) BDKRB1
SCHEMBL4339054 0.93 BDKRB1 (0.49) BDKRB1
SCHEMBL4339060 0.93 BDKRB1 (0.49) BDKRB1
SCHEMBL13614367 0.93 BDKRB1 (0.49) BDKRB1

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
US-7612060-B2 Triazoles and methods of use AMGEN INC. (US) 2009-11-03 US disclosed
US-7612060-B2 Triazoles and methods of use AMGEN INC. (US) 2009-11-03 US disclosed