SCHEMBL27080482

SCHEMBL27080482

COc1cc(-c2nccc(-c3cccc(-c4cnc(CN(C[C@@H]5CCC(=O)N5)C(=O)O)c(OC)n4)c3Cl)c2Cl)ccc1C=O

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDCD1 Q15116 20/20 0.58
▸ CD274 Q9NZQ7 20/20 0.58

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
SCHEMBL27080491 1.00 PDCD1 (0.58) PDCD1CD274
SCHEMBL29984170 0.92 PDCD1 (0.55) PDCD1CD274
SCHEMBL27080969 0.91 CD274 (0.54) PDCD1CD274
SCHEMBL27080973 0.91 CD274 (0.54) PDCD1CD274
SCHEMBL27081842 0.90 CD274 (0.46) PDCD1CD274
SCHEMBL27080743 0.89 CD274 (0.72) PDCD1CD274
SCHEMBL27080727 0.89 CD274 (0.72) PDCD1CD274
SCHEMBL21315426 0.87 PDCD1 (0.68) PDCD1CD274
SCHEMBL21315428 0.87 PDCD1 (0.68) PDCD1CD274
SCHEMBL29984214 0.87 CD274 (0.63) PDCD1CD274

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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