SCHEMBL27080490

SCHEMBL27080490

COc1cc(-c2nccc(-c3cccc(-c4ccc(CN(C[C@@H]5CCC(=O)N5)C(=O)O)c(OC)n4)c3Cl)c2Cl)cc(F)c1CN1CC2(CC(O)C2)C1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 20/20 0.52
▸ PDCD1LG2 Q9BQ51 9/20 0.52
▸ PDCD1 Q15116 11/20 0.50

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
SCHEMBL27080496 1.00 CD274 (0.52) CD274PDCD1LG2PDCD1
SCHEMBL29983278 0.93 CD274 (0.50) CD274PDCD1LG2PDCD1
SCHEMBL27080728 0.93 CD274 (0.59) CD274PDCD1LG2PDCD1
SCHEMBL27080721 0.93 CD274 (0.59) CD274PDCD1LG2PDCD1
SCHEMBL27079133 0.88 CD274 (0.70) CD274PDCD1LG2PDCD1
SCHEMBL27079127 0.88 CD274 (0.70) CD274PDCD1LG2PDCD1
SCHEMBL27079580 0.88 CD274 (0.70) CD274PDCD1LG2PDCD1
SCHEMBL27081059 0.86 CD274 (0.56) CD274PDCD1LG2PDCD1
SCHEMBL27081053 0.86 CD274 (0.56) CD274PDCD1LG2PDCD1
SCHEMBL29983639 0.86 CD274 (0.57) 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
Send feedback