SCHEMBL26334469

SCHEMBL26334469

COc1nc(-c2cccc(-c3cccc(-c4cnc(CNC5CCCC5)c(OC)n4)c3Cl)c2Cl)cnc1CNC[C@@H]1CCC(=O)N1

nearest known ligand 0.94

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 20/20 0.94
CD274 Q9NZQ7 20/20 0.94

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
SCHEMBL26334322 0.98 PDCD1 (0.94) PDCD1CD274
SCHEMBL26336687 0.98 PDCD1 (0.94) PDCD1CD274
SCHEMBL26333429 0.97 PDCD1 (1.00) PDCD1CD274
SCHEMBL21291056 0.97 PDCD1 (1.00) PDCD1CD274
Evixapodlin SCHEMBL29387636 0.93 PDCD1 (1.00) PDCD1CD274
Evixapodlin SCHEMBL21274280 0.93 PDCD1 (1.00) PDCD1CD274
Evixapodlin SCHEMBL26331593 0.93 PDCD1 (1.00) PDCD1CD274
Evixapodlin SCHEMBL21290636 0.93 PDCD1 (1.00) PDCD1CD274
Evixapodlin SCHEMBL21290535 0.93 PDCD1 (1.00) PDCD1CD274
SCHEMBL21290848 0.93 PDCD1 (1.00) 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