SCHEMBL30145157

SCHEMBL30145157

Cn1c(C(=O)Nc2cccc(Br)c2C#N)nc2c1CCN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 17/20 0.55
CD274 Q9NZQ7 17/20 0.55
PRMT5 O14744 1/20 0.42
WDR77 Q9BQA1 1/20 0.42
MAPK8 P45983 1/20 0.38
GRAMD1A Q96CP6 1/20 0.37

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
SCHEMBL20294221 1.00 PDCD1 (0.55) PDCD1CD274PRMT5WDR77MAPK8
SCHEMBL21565000 0.91 PDCD1 (0.58) PDCD1CD274
SCHEMBL30145362 0.88 PDCD1 (0.53) PDCD1CD274MAPK8GRAMD1A
SCHEMBL20293195 0.88 PDCD1 (0.53) PDCD1CD274MAPK8GRAMD1A
SCHEMBL30010862 0.87 PDCD1 (0.46) PDCD1CD274MAPK8GRAMD1A
SCHEMBL20293591 0.87 PDCD1 (0.54) PDCD1CD274MAPK8
SCHEMBL29812811 0.87 PDCD1 (0.54) PDCD1CD274MAPK8
SCHEMBL22675301 0.85 PDCD1 (0.59) PDCD1CD274
SCHEMBL20294264 0.84 PDCD1 (0.81) PDCD1CD274
SCHEMBL20294297 0.84 PDCD1 (0.66) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118908978-A Tetrahydro-imidazo [4,5-c ] pyridine derivatives as PD-L1 immunomodulators 因赛特公司 2024-11-08 CN disclosed
CN-112752756-B Tetrahydro-imidazo [4,5-c ] pyridine derivatives as PD-L1 immunomodulators 因赛特公司 2024-06-25 CN disclosed
CN-110267953-B Tetrahydroimidazo [4,5-C ] pyridine derivatives as inducers of PD-L1 internalization 因赛特公司 2022-12-20 CN disclosed