SCHEMBL31430552

SCHEMBL31430552

COC(=O)c1cc(N)c(O)cc1OC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.63
KDM4E B2RXH2 5/20 0.61
POLB P06746 2/20 0.51
ALDH1A1 P00352 5/20 0.46
HSD17B10 Q99714 3/20 0.46
MAPT P10636 2/20 0.46
HPGD P15428 2/20 0.46
GLA P06280 1/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
ATM Q13315 1/20 0.46
HTT P42858 2/20 0.46
CFTR P13569 1/20 0.46
ABL1 P00519 1/20 0.45
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44

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
SCHEMBL29424850 0.87 GAA (0.74) GAAKDM4EPOLBALDH1A1HSD17B10
SCHEMBL6473999 0.87 GAA (0.74) GAAKDM4EPOLBALDH1A1HSD17B10
SCHEMBL8902306 0.85 GAA (0.67) GAAKDM4EPOLBALDH1A1HSD17B10
SCHEMBL2900351 0.85 KDM4E (0.82) GAAKDM4EPOLBALDH1A1HSD17B10
SCHEMBL18863815 0.83 GAA (0.59) GAAKDM4EPOLBALDH1A1HSD17B10
SCHEMBL29370673 0.83 GAA (0.59) GAAKDM4EPOLBALDH1A1HSD17B10
SCHEMBL11385067 0.82 GAA (0.63) GAAKDM4EPOLBALDH1A1HSD17B10
SCHEMBL11568484 0.81 KDM4E (0.76) GAAKDM4EPOLBALDH1A1HSD17B10
SCHEMBL23874532 0.81 GAA (0.61) GAAKDM4EPOLBALDH1A1HSD17B10
SCHEMBL30002737 0.81 GAA (0.61) GAAKDM4EPOLBALDH1A1HSD17B10

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-2025050125-A1 SUBSTITUTED BENZOXAZOLYLAMINO BENZOXAZOLES IMMVENTION THERAPEUTIX (US) 2025-03-06 WO disclosed