SCHEMBL26330688

SCHEMBL26330688

CCNc1nc(-c2cccc(-c3cccc(-c4cnc(CN5CC6(CCC(=O)N6)C5)c(NCC)n4)c3Cl)c2Cl)cnc1CN1CC(CCC=O)(NC)C1

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDCD1 Q15116 20/20 0.80
▸ CD274 Q9NZQ7 20/20 0.80

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
SCHEMBL21289983 0.89 PDCD1 (1.00) PDCD1CD274
SCHEMBL21290638 0.83 PDCD1 (1.00) PDCD1CD274
SCHEMBL26318138 0.80 PDCD1 (0.81) PDCD1CD274
SCHEMBL21274552 0.79 PDCD1 (1.00) PDCD1CD274
SCHEMBL30529834 0.79 PDCD1 (1.00) PDCD1CD274
SCHEMBL21290906 0.78 CD274 (1.00) PDCD1CD274
SCHEMBL21290775 0.78 CD274 (1.00) PDCD1CD274
SCHEMBL21289949 0.77 CD274 (1.00) PDCD1CD274
SCHEMBL21290637 0.76 PDCD1 (1.00) PDCD1CD274
SCHEMBL21289952 0.76 PDCD1 (1.00) 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-4227302-A1 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2023-08-16 — — EP disclosed
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