SCHEMBL27080603

SCHEMBL27080603

COc1cc(-c2nccc(-c3cccc(NC(=O)c4ccc(CN(CCO)C(=O)O)cn4)c3C)c2Cl)ccc1CNC[C@@H]1CCC(=O)N1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 20/20 0.51
▸ PDCD1 Q15116 9/20 0.51
▸ PDCD1LG2 Q9BQ51 11/20 0.47

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
SCHEMBL27080610 1.00 CD274 (0.51) CD274PDCD1PDCD1LG2
SCHEMBL27082373 0.94 CD274 (0.49) CD274PDCD1PDCD1LG2
SCHEMBL27082378 0.94 CD274 (0.49) CD274PDCD1PDCD1LG2
SCHEMBL30836371 0.93 CD274 (0.52) CD274PDCD1PDCD1LG2
SCHEMBL30836266 0.93 CD274 (0.52) CD274PDCD1PDCD1LG2
SCHEMBL30836305 0.93 CD274 (0.52) CD274PDCD1PDCD1LG2
SCHEMBL29983784 0.93 CD274 (0.49) CD274PDCD1PDCD1LG2
SCHEMBL27080682 0.91 CD274 (0.52) CD274PDCD1PDCD1LG2
SCHEMBL27080634 0.91 CD274 (0.52) CD274PDCD1PDCD1LG2
SCHEMBL29982328 0.91 CD274 (0.58) 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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