SCHEMBL27081739

SCHEMBL27081739

O=C1CCC(CN(CCN2Cc3cc(-c4cccc(-c5ccnc(Cl)c5Cl)c4Cl)ncc3C2=O)C(=O)O)N1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 20/20 0.42
▸ PDCD1 Q15116 16/20 0.42
▸ PDCD1LG2 Q9BQ51 4/20 0.40

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
SCHEMBL27081733 1.00 CD274 (0.42) CD274PDCD1PDCD1LG2
SCHEMBL29983714 0.90 CD274 (0.42) CD274PDCD1PDCD1LG2
SCHEMBL23725965 0.84 CD274 (0.36) CD274PDCD1PDCD1LG2
SCHEMBL27080414 0.84 CD274 (0.36) CD274PDCD1PDCD1LG2
SCHEMBL27080962 0.80 CD274 (0.41) CD274PDCD1PDCD1LG2
SCHEMBL27080951 0.80 CD274 (0.41) CD274PDCD1PDCD1LG2
SCHEMBL25169156 0.79 CD274 (0.48) CD274PDCD1PDCD1LG2
SCHEMBL27081664 0.77 CD274 (0.45) CD274PDCD1PDCD1LG2
SCHEMBL27081644 0.77 CD274 (0.45) CD274PDCD1PDCD1LG2
SCHEMBL29983852 0.77 CD274 (0.42) 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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