SCHEMBL28903489

SCHEMBL28903489

Cc1c(-c2ccn3c(=O)c(CNC[C@@H]4CCC(=O)N4)cnc3c2)cccc1-c1ccn2c(=O)c(CNC[C@@H]3CCC(=O)N3)cnc2c1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 20/20 0.58
▸ PDCD1 Q15116 6/20 0.58
▸ PDCD1LG2 Q9BQ51 10/20 0.51

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
SCHEMBL25167382 0.99 CD274 (0.60) CD274PDCD1PDCD1LG2
SCHEMBL23724243 0.99 CD274 (0.60) CD274PDCD1PDCD1LG2
SCHEMBL23724410 0.99 CD274 (0.60) CD274PDCD1PDCD1LG2
SCHEMBL23724313 0.99 CD274 (0.60) CD274PDCD1PDCD1LG2
SCHEMBL23725681 0.94 CD274 (0.52) CD274PDCD1PDCD1LG2
SCHEMBL23725251 0.90 CD274 (0.61) CD274PDCD1PDCD1LG2
SCHEMBL25167335 0.90 CD274 (0.61) CD274PDCD1PDCD1LG2
SCHEMBL25169124 0.90 CD274 (0.61) CD274PDCD1PDCD1LG2
SCHEMBL23725916 0.90 CD274 (0.61) CD274PDCD1PDCD1LG2
SCHEMBL23727528 0.90 CD274 (0.53) CD274PDCD1PDCD1LG2

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-115413275-A Substituted 1,1 , -biphenyl compounds and methods of use thereof 爱彼特生物制药公司 2022-11-29 — — CN disclosed
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