SCHEMBL31354292

SCHEMBL31354292

COc1nc(-c2cccc(Br)c2C)cnc1C#N

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 14/20 0.43
CD274 Q9NZQ7 14/20 0.43
USP8 P40818 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
SQOR Q9Y6N5 3/20 0.37
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36

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
SCHEMBL23103160 0.85 CD274 (0.41) PDCD1CD274USP8L3MBTL1SQOR
SCHEMBL23103147 0.79 PDCD1 (0.52) PDCD1CD274
SCHEMBL31354213 0.79 PDCD1 (0.52) PDCD1CD274
SCHEMBL31004236 0.77 CD274 (0.42) PDCD1CD274
SCHEMBL23103161 0.77 CD274 (0.42) PDCD1CD274
SCHEMBL24660271 0.76 CD274 (0.43) PDCD1CD274
SCHEMBL31353950 0.75 CD274 (0.47) PDCD1CD274
SCHEMBL23103152 0.75 CD274 (0.47) PDCD1CD274
SCHEMBL17123788 0.69 USP8 (0.40) USP8SQOR
SCHEMBL28331277 0.69 MAPT (0.50) L3MBTL1

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-2025029075-A1 NOVEL BIPHENYL DERIVATIVE AS PD-L1 INHIBITOR (주)아이랩 2025-02-06 WO disclosed