SCHEMBL30836706

SCHEMBL30836706

COc1nc(-c2ccnc(-c3cccc(NC(=O)c4cc(CO)ccn4)c3C)c2Cl)ccc1CN(C[C@@H]1CCC(=O)N1)C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDCD1LG2 Q9BQ51 20/20 0.44
CD274 Q9NZQ7 20/20 0.44

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
SCHEMBL30836605 0.95 CD274 (0.42) PDCD1LG2CD274
SCHEMBL30836581 0.94 CD274 (0.48) PDCD1LG2CD274
SCHEMBL30836684 0.93 CD274 (0.43) PDCD1LG2CD274
SCHEMBL30836695 0.92 CD274 (0.45) PDCD1LG2CD274
SCHEMBL30836755 0.91 CD274 (0.43) PDCD1LG2CD274
SCHEMBL30836597 0.91 CD274 (0.44) PDCD1LG2CD274
SCHEMBL30836691 0.91 CD274 (0.44) PDCD1LG2CD274
SCHEMBL30836580 0.90 CD274 (0.45) PDCD1LG2CD274
SCHEMBL30836608 0.90 CD274 (0.44) PDCD1LG2CD274
SCHEMBL29143954 0.89 CD274 (0.43) PDCD1LG2CD274

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