SCHEMBL31455673

SCHEMBL31455673

COC(=O)c1ccc(C(=O)O)cc1N(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.47
ALDH1A1 P00352 6/20 0.47
HPGD P15428 4/20 0.47
HSD17B10 Q99714 3/20 0.47
ATM Q13315 3/20 0.47
GLA P06280 2/20 0.47
GAA P10253 2/20 0.47
MAPT P10636 2/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
HCAR3 P49019 1/20 0.46
KDM6B O15054 1/20 0.44
KDM5C P41229 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
KDM2A Q9Y2K7 1/20 0.44
KDM3A Q9Y4C1 1/20 0.44
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA7 P43166 2/20 0.43

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
SCHEMBL1730549 1.00 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10ATM
SCHEMBL8922678 0.90 KDM4E (0.59) KDM4EALDH1A1HPGDHSD17B10ATM
SCHEMBL6644845 0.87 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10ATM
SCHEMBL642243 0.84 HCAR3 (0.53) KDM4EALDH1A1GLAGAAMAPT
SCHEMBL6647697 0.84 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10ATM
SCHEMBL29771091 0.83 HRH3 (0.48) KDM4EALDH1A1HSD17B10MAPTHCAR3
SCHEMBL820141 0.80 KDM4E (0.55) KDM4EALDH1A1HPGDHSD17B10ATM
SCHEMBL29699657 0.80 KDM4E (0.55) KDM4EALDH1A1HPGDHSD17B10ATM
SCHEMBL1730827 0.79 ALDH1A1 (0.59) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL1018113 0.79 KDM4E (0.53) KDM4EALDH1A1HPGDHSD17B10ATM

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-2025059562-A1 SUBSTITUTED AMINOPYRIDINE COMPOUNDS AND METHODS OF TREATING DISEASE USING SAME ATAVISTIK BIO, INC. (US) 2025-03-20 WO disclosed