SCHEMBL31184792

SCHEMBL31184792

COC(=O)c1c(N)ccnc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.45
ALDH1A1 P00352 5/20 0.45
GAA P10253 3/20 0.45
GLA P06280 2/20 0.45
HPGD P15428 3/20 0.44
HSD17B10 Q99714 4/20 0.42
CFTR P13569 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
DYRK1A Q13627 1/20 0.40
ROCK1 Q13464 1/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
KDM6B O15054 1/20 0.39
KDM5C P41229 1/20 0.39
KDM4C Q9H3R0 1/20 0.39

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
SCHEMBL27610033 0.84 ALDH1A1 (0.46) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL8325905 0.82 L3MBTL1 (0.46) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL31368236 0.81 CA12 (0.44) KDM4EALDH1A1HPGDHSD17B10CA12
SCHEMBL16726632 0.81 CA12 (0.44) KDM4EALDH1A1HPGDHSD17B10CA12
SCHEMBL31145860 0.81 KDM4E (0.44) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL29274165 0.81 ALDH1A1 (0.44) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL1178762 0.81 ALDH1A1 (0.44) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL16649076 0.81 KDM4E (0.44) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL17948707 0.80 KDM4E (0.46) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL31720064 0.80 KDM4E (0.46) KDM4EALDH1A1GAAGLAHPGD

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
WO-2024220626-A1 SMALL MOLECULE MODULATORS OF OGG1 AZKARRA THERAPEUTICS, INC. (US) 2024-10-24 WO disclosed