SCHEMBL29982989

SCHEMBL29982989

COc1cc(-c2nccc(-c3cccc(-c4ccc(C5=NCCN5)c(OC)n4)c3Cl)c2Cl)ccc1C1=NCCN1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 20/20 0.71
▸ PDCD1LG2 Q9BQ51 16/20 0.71
▸ PDCD1 Q15116 4/20 0.60

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
SCHEMBL27079047 1.00 CD274 (0.71) CD274PDCD1LG2PDCD1
SCHEMBL27081033 0.91 CD274 (0.64) CD274PDCD1LG2PDCD1
SCHEMBL29984469 0.91 CD274 (0.64) CD274PDCD1LG2PDCD1
SCHEMBL21507291 0.84 CD274 (1.00) CD274PDCD1LG2PDCD1
SCHEMBL27081077 0.84 CD274 (0.85) CD274PDCD1LG2PDCD1
SCHEMBL31622017 0.83 CD274 (1.00) CD274PDCD1LG2PDCD1
SCHEMBL21497025 0.83 CD274 (1.00) CD274PDCD1LG2PDCD1
SCHEMBL29983151 0.82 CD274 (0.78) CD274PDCD1LG2PDCD1
SCHEMBL29983740 0.82 CD274 (0.78) CD274PDCD1LG2PDCD1
SCHEMBL27079175 0.82 CD274 (0.78) 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 4 patents. 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 claimed
WO-2022208269-A2 SUBSTITUTED 1-ARYL-1'-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1'-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2022-10-06 — — WO claimed
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
WO-2022208269-A2 SUBSTITUTED 1-ARYL-1'-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1'-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2022-10-06 — — WO disclosed
Send feedback