SCHEMBL27080903

SCHEMBL27080903

COc1nc(-c2cccc(-c3ccnc(-c4cc(OC)c5nc(CN6CC7(C6)CN(C(C)=O)C7)cn5c4)c3Cl)c2Cl)ccc1CN(CC1CCC(=O)N1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 20/20 0.54
▸ PDCD1 Q15116 6/20 0.54
▸ PDCD1LG2 Q9BQ51 14/20 0.54

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
SCHEMBL27080892 1.00 CD274 (0.54) CD274PDCD1PDCD1LG2
SCHEMBL29983748 0.93 CD274 (0.53) CD274PDCD1PDCD1LG2
SCHEMBL27080575 0.93 CD274 (0.56) CD274PDCD1PDCD1LG2
SCHEMBL27080564 0.93 CD274 (0.56) CD274PDCD1PDCD1LG2
SCHEMBL27080458 0.93 CD274 (0.51) CD274PDCD1PDCD1LG2
SCHEMBL27080445 0.93 CD274 (0.51) CD274PDCD1PDCD1LG2
SCHEMBL27082114 0.91 PDCD1LG2 (0.56) CD274PDCD1LG2
SCHEMBL27082108 0.91 PDCD1LG2 (0.56) CD274PDCD1LG2
SCHEMBL27080980 0.89 CD274 (0.49) CD274PDCD1PDCD1LG2
SCHEMBL27080972 0.89 CD274 (0.49) 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
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
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