SCHEMBL30616465

SCHEMBL30616465

Cn1c(=O)c([N+](=O)[O-])c(N2CCN(C(c3ccccc3)c3ccccc3)CC2)c2nc(C#N)ccc21

nearest known ligand 0.83

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGKA P23743 9/20 0.83
DGKZ Q13574 8/20 0.83
DGKI O75912 3/20 0.83
DGKG P49619 2/20 0.83
DGKB Q9Y6T7 2/20 0.83
DGKK Q5KSL6 1/20 0.83
HTR2A P28223 1/20 0.42
RAB9A P51151 2/20 0.39
PAX8 Q06710 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 2/20 0.37
MAPT P10636 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
P2RX7 Q99572 1/20 0.36

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
SCHEMBL23293196 1.00 DGKA (0.83) DGKADGKZDGKIDGKGDGKB
SCHEMBL23293351 0.95 DGKA (0.79) DGKADGKZDGKIDGKGDGKB
SCHEMBL30422106 0.95 DGKA (0.79) DGKADGKZDGKIDGKGDGKB
SCHEMBL23293353 0.95 DGKA (0.79) DGKADGKZDGKIDGKGDGKB
SCHEMBL23293267 0.93 DGKA (0.72) DGKADGKZDGKIDGKGDGKB
SCHEMBL21830991 0.91 DGKA (1.00) DGKADGKZDGKIDGKGDGKB
SCHEMBL29654799 0.91 DGKA (1.00) DGKADGKZDGKIDGKGDGKB
SCHEMBL30616441 0.90 DGKZ (0.68) DGKADGKZDGKIDGKGDGKB
SCHEMBL23293283 0.90 DGKZ (0.68) DGKADGKZDGKIDGKGDGKB
SCHEMBL23293265 0.86 DGKA (0.84) DGKADGKZDGKIDGKGDGKB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112585139-B Naphthyridinone compounds as T cell activators 百时美施贵宝公司 2023-12-01 CN claimed
CN-112585139-B Naphthyridinone compounds as T cell activators 百时美施贵宝公司 2023-12-01 CN disclosed