SCHEMBL29981852

SCHEMBL29981852

COc1cc(-c2nccc(-c3cccc(NC(=O)c4ccc(CNC[C@H]5CCC(=O)N5)cn4)c3C)c2Cl)cc(F)c1CNC[C@H]1CCC(=O)N1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 20/20 0.56
▸ PDCD1LG2 Q9BQ51 3/20 0.53
▸ PDCD1 Q15116 1/20 0.53

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
SCHEMBL29983632 1.00 CD274 (0.56) CD274PDCD1LG2PDCD1
SCHEMBL27079291 1.00 CD274 (0.56) CD274PDCD1LG2PDCD1
SCHEMBL27080888 1.00 CD274 (0.56) CD274PDCD1LG2PDCD1
SCHEMBL27079607 1.00 CD274 (0.56) CD274PDCD1LG2PDCD1
SCHEMBL27079026 1.00 CD274 (0.56) CD274PDCD1LG2PDCD1
SCHEMBL29983987 1.00 CD274 (0.56) CD274PDCD1LG2PDCD1
SCHEMBL27079032 1.00 CD274 (0.56) CD274PDCD1LG2PDCD1
SCHEMBL29983335 1.00 CD274 (0.56) CD274PDCD1LG2PDCD1
SCHEMBL30836308 0.96 CD274 (0.56) CD274PDCD1LG2PDCD1
SCHEMBL30836410 0.96 CD274 (0.56) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4313968-A2 SUBSTITUTED 1-ARYL-1'-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1'-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME Arbutus Biopharma Corporation (CA) 2024-02-07 — — EP claimed
WO-2022208269-A2 SUBSTITUTED 1-ARYL-1'-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1'-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2022-10-06 — — WO claimed
EP-4313968-A2 SUBSTITUTED 1-ARYL-1'-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1'-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME Arbutus Biopharma Corporation (CA) 2024-02-07 — — EP disclosed
WO-2022208269-A2 SUBSTITUTED 1-ARYL-1'-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1'-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2022-10-06 — — WO disclosed
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