SCHEMBL26318631

SCHEMBL26318631

C=C1CCC2(CN(Cc3ncc(-c4cccc(-c5cccc(-c6ccc(C7=NCCN7)c(OC)n6)c5Cl)c4C)nc3OC)C2)N1

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 20/20 0.79
▸ PDCD1 Q15116 17/20 0.79
▸ PDCD1LG2 Q9BQ51 3/20 0.64

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
SCHEMBL26318608 0.88 CD274 (0.79) CD274PDCD1PDCD1LG2
SCHEMBL21290684 0.88 CD274 (1.00) CD274PDCD1PDCD1LG2
SCHEMBL26318899 0.85 PDCD1 (0.80) CD274PDCD1
SCHEMBL26322530 0.81 PDCD1 (0.82) CD274PDCD1
SCHEMBL21274554 0.80 CD274 (1.00) CD274PDCD1PDCD1LG2
SCHEMBL30486766 0.80 CD274 (1.00) CD274PDCD1PDCD1LG2
SCHEMBL26317991 0.80 PDCD1 (0.82) CD274PDCD1
SCHEMBL26328663 0.79 CD274 (0.84) CD274PDCD1PDCD1LG2
SCHEMBL21290691 0.79 CD274 (1.00) CD274PDCD1PDCD1LG2
SCHEMBL26318474 0.79 PDCD1 (0.74) CD274PDCD1

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-4227302-A1 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2023-08-16 — — EP disclosed
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