SCHEMBL27080215

SCHEMBL27080215

COc1cc(-c2nccc(-c3cccc(NC(=O)c4ccc(CN(CCO)C(=O)O)cn4)c3Cl)c2Cl)ccc1CNC1CCN(C(C)=O)CC1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 20/20 0.43
▸ PDCD1LG2 Q9BQ51 1/20 0.43
▸ PDCD1 Q15116 17/20 0.41

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
SCHEMBL27081043 0.96 CD274 (0.46) CD274PDCD1
SCHEMBL29983878 0.93 CD274 (0.40) CD274PDCD1LG2PDCD1
SCHEMBL27079293 0.91 CD274 (0.48) CD274PDCD1LG2PDCD1
SCHEMBL30836458 0.90 CD274 (0.53) CD274PDCD1
SCHEMBL29983642 0.90 CD274 (0.43) CD274PDCD1
SCHEMBL29982764 0.89 CD274 (0.51) CD274PDCD1LG2PDCD1
SCHEMBL27078713 0.89 CD274 (0.51) CD274PDCD1LG2PDCD1
SCHEMBL27081086 0.87 PDCD1 (0.54) CD274PDCD1
SCHEMBL27079039 0.86 CD274 (0.51) CD274PDCD1LG2PDCD1
SCHEMBL29143902 0.86 CD274 (0.48) 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 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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