SCHEMBL24446434

SCHEMBL24446434

CNc1cccc(-c2cccc(NC(=O)c3cc(C4CC4)c(CN4CCC(O)C4)cn3)c2C)c1C

nearest known ligand 0.93

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDCD1 Q15116 20/20 0.93
▸ CD274 Q9NZQ7 20/20 0.93

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
SCHEMBL22779775 1.00 PDCD1 (0.93) PDCD1CD274
SCHEMBL21229402 0.97 PDCD1 (1.00) PDCD1CD274
SCHEMBL21229401 0.97 PDCD1 (1.00) PDCD1CD274
SCHEMBL30112623 0.97 PDCD1 (1.00) PDCD1CD274
SCHEMBL22779887 0.95 PDCD1 (0.93) PDCD1CD274
SCHEMBL22779868 0.94 PDCD1 (0.93) PDCD1CD274
SCHEMBL24659902 0.93 PDCD1 (0.92) PDCD1CD274
SCHEMBL24660014 0.93 PDCD1 (0.92) PDCD1CD274
SCHEMBL24660092 0.93 PDCD1 (0.92) PDCD1CD274
SCHEMBL22675459 0.92 PDCD1 (0.90) PDCD1CD274

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
EP-4001274-A1 BIPHENYL DERIVATIVES FOR BLOCKING PD-1/PD-L1 INTERACTION, PREPARATION METHOD THEREFOR AND USE THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2022-05-25 — — EP disclosed
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