SCHEMBL26332401

SCHEMBL26332401

COc1nc(-c2cccc(-c3cccc(-c4cnc(CN5CCC6(CCC(=O)N6)CC5)c(OC)n4)c3Cl)c2Cl)cnc1CNCC1CCC(=O)N1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDCD1 Q15116 20/20 1.00
▸ CD274 Q9NZQ7 20/20 1.00

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
SCHEMBL21290893 1.00 PDCD1 (1.00) PDCD1CD274
SCHEMBL26332333 0.96 PDCD1 (1.00) PDCD1CD274
SCHEMBL21290743 0.96 PDCD1 (1.00) PDCD1CD274
SCHEMBL21291092 0.94 CD274 (1.00) PDCD1CD274
SCHEMBL26334706 0.94 CD274 (1.00) PDCD1CD274
SCHEMBL25774583 0.91 PDCD1 (1.00) PDCD1CD274
SCHEMBL21290068 0.91 PDCD1 (1.00) PDCD1CD274
SCHEMBL21291096 0.90 PDCD1 (0.92) PDCD1CD274
SCHEMBL26330028 0.90 PDCD1 (0.86) PDCD1CD274
SCHEMBL26330284 0.90 PDCD1 (0.86) 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-4227302-A1 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2023-08-16 — — EP disclosed
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