SCHEMBL13614329

SCHEMBL13614329

CC(C)(C)NCc1ccc2c(c1)CCC[C@@H]2n1cc(C[C@@H]2C(=O)NC=CN2S(=O)(=O)c2ccccc2)nn1

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 20/20 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
SCHEMBL4345048 1.00 BDKRB1 (0.49) BDKRB1
SCHEMBL4345052 1.00 BDKRB1 (0.49) BDKRB1
SCHEMBL4346977 0.94 BDKRB1 (0.49) BDKRB1
SCHEMBL4346984 0.94 BDKRB1 (0.49) BDKRB1
SCHEMBL13614332 0.94 BDKRB1 (0.49) BDKRB1
SCHEMBL4335094 0.93 BDKRB1 (0.49) BDKRB1
SCHEMBL13614334 0.93 BDKRB1 (0.49) BDKRB1
SCHEMBL4335104 0.93 BDKRB1 (0.49) BDKRB1
SCHEMBL4351180 0.93 BDKRB1 (0.59) BDKRB1
SCHEMBL13614340 0.93 BDKRB1 (0.59) 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