SCHEMBL30836657

SCHEMBL30836657

COCCNCc1ccc(C(=O)Nc2cccc(-c3nccc(-c4ccc(CN(C[C@@H]5CCC(=O)N5)C(=O)OC(C)(C)C)c(OC)n4)c3Cl)c2Cl)nc1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 20/20 0.45
PDCD1 Q15116 8/20 0.45
PDCD1LG2 Q9BQ51 12/20 0.45

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
SCHEMBL30836765 0.96 CD274 (0.49) CD274PDCD1PDCD1LG2
SCHEMBL30836606 0.91 CD274 (0.46) CD274PDCD1PDCD1LG2
SCHEMBL30836647 0.90 CD274 (0.44) CD274PDCD1PDCD1LG2
SCHEMBL30836604 0.90 CD274 (0.47) CD274PDCD1PDCD1LG2
SCHEMBL30836640 0.89 CD274 (0.51) CD274PDCD1PDCD1LG2
SCHEMBL30836594 0.89 CD274 (0.46) CD274PDCD1PDCD1LG2
SCHEMBL30836757 0.89 CD274 (0.46) CD274PDCD1PDCD1LG2
SCHEMBL30836684 0.88 CD274 (0.43) CD274PDCD1PDCD1LG2
SCHEMBL30836747 0.88 CD274 (0.45) CD274PDCD1PDCD1LG2
SCHEMBL30836567 0.87 CD274 (0.60) 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
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