SCHEMBL19360579

SCHEMBL19360579

CCSc1ccc(CNC(=O)c2ccc3c(c2)cc(Cn2nc(C)cc2C(F)(F)F)n3C2CC2)nc1

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 18/20 0.42
NAMPT P43490 2/20 0.34

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
SCHEMBL19360408 0.87 RORC (0.52) RORC
SCHEMBL19360646 0.83 RORC (0.51) RORC
SCHEMBL19360487 0.82 RORC (0.39) RORCNAMPT
SCHEMBL19360555 0.80 RORC (0.63) RORC
SCHEMBL19360578 0.79 RORC (0.51) RORCNAMPT
SCHEMBL19360485 0.79 RORC (0.51) RORC
SCHEMBL19360607 0.78 L3MBTL1 (0.41) RORC
SCHEMBL19360610 0.77 GAA (0.42) RORC
SCHEMBL19360361 0.74 RORC (0.61) RORC
SCHEMBL22512545 0.73 RORC (0.55) 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