SCHEMBL9575154

SCHEMBL9575154

Cc1cc(NC(=O)C(=O)NN)cc(C(C)(C)C)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.53
ALDH1A1 P00352 3/20 0.53
TDP1 Q9NUW8 1/20 0.53
KDM4E B2RXH2 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.38
CA2 P00918 2/20 0.38
POLB P06746 1/20 0.38
TYR P14679 1/20 0.38
GLRA3 O75311 1/20 0.38
GLRB P48167 1/20 0.38
MEN1 O00255 1/20 0.36
GALR3 O60755 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CA1 P00915 1/20 0.35

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
SCHEMBL8335780 0.91 GAA (0.64) GAAALDH1A1TDP1KDM4EMAPK1
SCHEMBL9575249 0.86 KDM4E (0.42) GAAALDH1A1TDP1KDM4ECYP1A2
SCHEMBL29029983 0.78 GAA (0.51) GAAALDH1A1TDP1CYP1A2CYP2C9
SCHEMBL23539085 0.76 GAA (0.47) GAAALDH1A1TDP1KDM4ECYP1A2
SCHEMBL9575276 0.76 GAA (0.45) GAAALDH1A1TDP1KDM4EMAPK1
SCHEMBL9377717 0.76 GAA (0.66) GAAALDH1A1TDP1SMN1; SMN2CA2
SCHEMBL9812317 0.74 GAA (0.68) GAAALDH1A1TDP1SMN1; SMN2CA2
SCHEMBL7303738 0.74 NPC1 (0.55) GAAALDH1A1TDP1MAPK1SMN1; SMN2
SCHEMBL9575477 0.74 GAA (0.43) GAAALDH1A1TDP1KDM4EMAPK1
SCHEMBL295404 0.73 ALDH1A1 (0.72) GAAALDH1A1TDP1CYP1A2CYP2C9

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
EP-0303280-B1 PHENOLIC ANTIOXIDANT HYDRAZIDES ATOCHEM NORTH AMERICA, INC. (US) 1993-03-24 EP disclosed
EP-0303280-A2 Phenolic antioxidant hydrazides ATOCHEM NORTH AMERICA, INC. (US) 1989-02-15 EP disclosed
US-4801749-A Phenolic antioxidant hydrazides PENNWALT CORPORATION (US) 1989-01-31 US disclosed