SCHEMBL24613243

SCHEMBL24613243

CNc1cncc(COc2nc(O[C@H]3CCc4c(-c5cccc(-c6ccc(C7=NCCN7)cc6)c5Cl)cccc43)c(Cl)cc2CN[C@@](C)(CO)C(=O)O)c1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 20/20 0.67
PDCD1 Q15116 16/20 0.67

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
SCHEMBL23961413 1.00 CD274 (0.67) CD274PDCD1
SCHEMBL23961522 0.95 CD274 (0.59) CD274PDCD1
SCHEMBL24613777 0.95 CD274 (0.59) CD274PDCD1
SCHEMBL23961510 0.92 CD274 (0.56) CD274PDCD1
SCHEMBL23949700 0.92 CD274 (0.66) CD274PDCD1
SCHEMBL23949023 0.92 CD274 (0.66) CD274PDCD1
SCHEMBL23949798 0.86 CD274 (0.59) CD274PDCD1
SCHEMBL23961487 0.86 PDCD1 (0.63) CD274PDCD1
SCHEMBL23949526 0.84 CD274 (0.57) CD274PDCD1
SCHEMBL23949025 0.84 CD274 (0.57) 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-4026835-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2022-07-13 EP disclosed