SCHEMBL19360549

SCHEMBL19360549

CC(C)n1c(Cc2ccc(C(F)(F)F)cc2Cl)cc2cc(C(=O)O)ccc21

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RORC P51449 12/20 0.49
MRGPRX4 Q96LA9 4/20 0.41
CCR2 P41597 1/20 0.39
EPHX2 P34913 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38

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
SCHEMBL19360548 0.89 RORC (0.49) RORCMRGPRX4PPARG
SCHEMBL19360326 0.89 RORC (0.49) RORCEPHX2NR1H4PPARGPPARA
SCHEMBL19360379 0.84 RORC (0.65) RORC
SCHEMBL19360574 0.84 RORC (0.65) RORCMRGPRX4PPARG
SCHEMBL19360317 0.81 RORC (0.65) RORCMRGPRX4
SCHEMBL19360368 0.81 RORC (0.63) RORCEPHX2PPARG
SCHEMBL19360306 0.80 RORC (0.65) RORCMRGPRX4EPHX2PPARG
SCHEMBL19360387 0.80 RORC (0.81) RORC
SCHEMBL19360322 0.78 RORC (0.49) RORC
SCHEMBL19360371 0.76 RORC (0.62) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107531679-B Aromatic amide derivative, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2021-07-02 CN disclosed
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