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SCHEMBL26319418

SCHEMBL26319418

C=C1CC[C@@H](CNCc2ncc(-c3cccc(-c4cccc(-c5cnc(CN6CC(O)C6)c(OC)n5)c4Cl)c3Cl)nc2OC)N1

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDCD1 Q15116 20/20 0.83
▸ CD274 Q9NZQ7 20/20 0.83

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
SCHEMBL26322426 0.95 PDCD1 (0.78) PDCD1CD274
SCHEMBL26323018 0.95 PDCD1 (0.84) PDCD1CD274
SCHEMBL26319300 0.93 PDCD1 (0.84) PDCD1CD274
SCHEMBL26319462 0.92 PDCD1 (0.84) PDCD1CD274
SCHEMBL21290753 0.91 PDCD1 (1.00) PDCD1CD274
SCHEMBL26334783 0.91 PDCD1 (1.00) PDCD1CD274
SCHEMBL26321473 0.91 PDCD1 (0.71) PDCD1CD274
SCHEMBL26317352 0.91 PDCD1 (0.71) PDCD1CD274
SCHEMBL26320617 0.90 PDCD1 (0.70) PDCD1CD274
SCHEMBL26320432 0.89 PDCD1 (0.73) 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