SCHEMBL30836709

SCHEMBL30836709

COc1nc(-c2ccnc(-c3cccc(NC(=O)c4ncc(CNCCO)n4C)c3C)c2Cl)ccc1CN(C[C@@H]1CCC(=O)N1)C(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 20/20 0.47
PDCD1LG2 Q9BQ51 11/20 0.47
PDCD1 Q15116 9/20 0.43

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
SCHEMBL30836671 0.91 CD274 (0.43) CD274PDCD1LG2PDCD1
SCHEMBL30836773 0.91 CD274 (0.42) CD274PDCD1LG2PDCD1
SCHEMBL30836650 0.89 CD274 (0.40) CD274PDCD1LG2PDCD1
SCHEMBL30836576 0.89 CD274 (0.51) CD274PDCD1LG2PDCD1
SCHEMBL30836581 0.89 CD274 (0.48) CD274PDCD1LG2PDCD1
SCHEMBL30836771 0.88 CD274 (0.49) CD274PDCD1LG2PDCD1
SCHEMBL30836445 0.88 CD274 (0.62) CD274PDCD1LG2PDCD1
SCHEMBL30836463 0.88 CD274 (0.62) CD274PDCD1LG2PDCD1
SCHEMBL30836353 0.88 CD274 (0.62) CD274PDCD1LG2PDCD1
SCHEMBL30836662 0.87 CD274 (0.47) CD274PDCD1LG2PDCD1

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
WO-2024069448-A1 SUBSTITUTED 1-ARYLAMINOCARBONYL-1'-HETEROARYL COMPOUNDS, SUBSTITUTED 1-HETEROARYLAMINOCARBONYL-1'-HETEROARYL COMPOUNDS AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2024-04-04 WO disclosed