SCHEMBL19360514

SCHEMBL19360514

CCSc1ccc(CNC(=O)c2ccc3c(c2)cc(Cc2ccccc2C#N)n3C(C)C)cc1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RORC P51449 16/20 0.62
SIRT2 Q8IXJ6 1/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 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
SCHEMBL19360486 0.87 RORC (0.81) RORC
SCHEMBL19360310 0.86 RORC (0.77) RORC
SCHEMBL19360653 0.85 RORC (0.62) RORC
SCHEMBL19360638 0.82 RORC (0.63) RORCMEN1POLBKMT2A
SCHEMBL19360452 0.82 RORC (0.63) RORCMEN1POLBKMT2A
SCHEMBL19360411 0.81 RORC (0.61) RORC
SCHEMBL19360331 0.78 RORC (0.74) RORC
SCHEMBL19360373 0.76 RORC (1.00) RORC
SCHEMBL19360538 0.76 RORC (0.65) RORC
SCHEMBL19360509 0.76 RORC (0.64) RORC

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