SCHEMBL19360552

SCHEMBL19360552

CCSc1ccc(CNC(=O)c2ccc3c(c2)cc(CN2CCCCC2CC)n3C(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RORC P51449 13/20 0.47
MAPT P10636 2/20 0.40
POLB P06746 1/20 0.39
CACNA1G O43497 3/20 0.38
HTR3A P46098 2/20 0.38
TP53 P04637 1/20 0.37

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
SCHEMBL19360508 0.88 RORC (0.64) RORC
SCHEMBL19360400 0.81 RORC (0.51) RORC
SCHEMBL19360653 0.78 RORC (0.62) RORC
SCHEMBL19360638 0.78 RORC (0.63) RORCPOLB
SCHEMBL19360452 0.78 RORC (0.63) RORCPOLB
SCHEMBL19360519 0.76 RORC (0.49) RORCMAPTPOLBTP53
SCHEMBL28579311 0.75 RORC (0.61) RORC
SCHEMBL19360649 0.74 RORC (0.43) RORCMAPTTP53
SCHEMBL19360310 0.74 RORC (0.77) RORC
SCHEMBL19360514 0.73 RORC (0.62) RORCPOLB

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
WO-2017157332-A1 AROMATIC AMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL APPLICATIONS THEREOF 江苏恒瑞医药股份有限公司 2017-09-21 WO disclosed