SCHEMBL19360340

SCHEMBL19360340

CCS(=O)(=O)c1ccc(CNC(=O)c2ccc3c(c2)cc(CN2CCC(C)CC2)n3C2CC2)nc1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 18/20 0.52
NAMPT P43490 2/20 0.44

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
SCHEMBL19360342 0.91 RORC (0.53) RORC
SCHEMBL19360484 0.91 RORC (0.51) RORCNAMPT
SCHEMBL19360627 0.88 RORC (0.61) RORC
SCHEMBL19360631 0.87 RORC (0.50) RORCNAMPT
SCHEMBL19360502 0.87 RORC (0.42) RORCNAMPT
SCHEMBL19360628 0.87 RORC (0.50) RORCNAMPT
SCHEMBL19360578 0.85 RORC (0.51) RORCNAMPT
SCHEMBL19360412 0.84 RORC (0.56) RORC
SCHEMBL19360497 0.83 RORC (0.57) RORC
SCHEMBL19360501 0.83 RORC (0.50) 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