SCHEMBL31145840

SCHEMBL31145840

NC(=O)c1ccc(CNC[C@H]2CCC(=O)N2)cn1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 19/20 0.58
▸ PDCD1LG2 Q9BQ51 1/20 0.58
▸ PDCD1 Q15116 15/20 0.45
▸ VNN1 O95497 1/20 0.41

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
SCHEMBL22675478 0.86 CD274 (0.56) CD274PDCD1LG2PDCD1
SCHEMBL21507062 0.73 CD274 (1.00) CD274PDCD1LG2PDCD1
SCHEMBL24722594 0.73 CD274 (0.53) CD274PDCD1LG2PDCD1
SCHEMBL1776816 0.73 CD274 (0.53) CD274PDCD1LG2PDCD1
SCHEMBL23198417 0.73 CD274 (0.54) CD274PDCD1LG2PDCD1
SCHEMBL27717312 0.73 CD274 (0.53) CD274PDCD1LG2PDCD1
SCHEMBL27080569 0.72 CD274 (0.63) CD274PDCD1LG2PDCD1
SCHEMBL27080574 0.72 CD274 (0.63) CD274PDCD1LG2PDCD1
SCHEMBL2644039 0.72 VNN1 (0.53) VNN1
SCHEMBL22675492 0.71 IRAK4 (0.39) —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688777-A1 NOVEL PD-L1 INHIBITORS Affirma Biotech S. L. (ES) 2026-02-11 — — EP disclosed
WO-2024200308-A1 NOVEL PD-L1 INHIBITORS Affirma Biotech S. L. (ES) 2024-10-03 — — WO disclosed
Send feedback