SCHEMBL23636632

SCHEMBL23636632

CCS(=O)(=O)c1ccc(CNC(=O)c2ccc(N3C(=O)CC(Oc4ccc(C(F)(F)F)cc4)C3=O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 19/20 0.50
▸ MAPK14 Q16539 1/20 0.45

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
SCHEMBL23636631 1.00 RORC (0.50) RORCMAPK14
SCHEMBL23636630 0.86 MCHR1 (0.51) RORCMAPK14
SCHEMBL23637002 0.84 RORC (0.47) RORC
SCHEMBL23636633 0.84 RORC (0.47) RORC
SCHEMBL23636940 0.83 RORC (0.49) RORCMAPK14
SCHEMBL23636926 0.83 RORC (0.49) RORCMAPK14
SCHEMBL23642189 0.82 RORC (0.53) RORCMAPK14
SCHEMBL23636932 0.81 RORC (0.49) RORCMAPK14
SCHEMBL23636939 0.80 RORC (0.47) RORCMAPK14
SCHEMBL23632655 0.79 RORC (0.52) RORCMAPK14

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-2021139599-A1 RORγT INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 东莞市东阳光新药研发有限公司 2021-07-15 — — WO disclosed
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