SCHEMBL29143950

SCHEMBL29143950

[CH2]c1ccc(C(=O)Nc2cccc(-c3ccnc(-c4ccc(CNC5CCOCC5)c(OC)c4)c3Cl)c2C)nc1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDCD1 Q15116 20/20 0.61
▸ CD274 Q9NZQ7 20/20 0.61

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
SCHEMBL27079529 0.93 PDCD1 (0.62) PDCD1CD274
SCHEMBL29983023 0.93 PDCD1 (0.62) PDCD1CD274
SCHEMBL29144038 0.90 CD274 (0.51) PDCD1CD274
SCHEMBL29983431 0.89 PDCD1 (0.57) PDCD1CD274
SCHEMBL27078999 0.89 PDCD1 (0.57) PDCD1CD274
SCHEMBL27080497 0.88 PDCD1 (0.54) PDCD1CD274
SCHEMBL29982330 0.88 PDCD1 (0.54) PDCD1CD274
SCHEMBL27081086 0.86 PDCD1 (0.54) PDCD1CD274
SCHEMBL29143902 0.85 CD274 (0.48) PDCD1CD274
SCHEMBL29143977 0.85 CD274 (0.65) 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
CN-117412959-A Substituted 1-aryl-1 '-heteroaryl compounds, substituted 1,1' -biaryl compounds, and methods of use thereof 爱彼特生物制药公司 2024-01-16 — — CN disclosed
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