SCHEMBL9725151

SCHEMBL9725151

CC(=O)c1cccc(C(N)=O)c1C(C)=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.46
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
IRAK4 Q9NWZ3 1/20 0.44
METAP2 P50579 1/20 0.42
PARP1 P09874 9/20 0.42
GAA P10253 1/20 0.41
BCAT2 O15382 1/20 0.41
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
PDPK1 O15530 1/20 0.40
KMT2A Q03164 1/20 0.39
SIRT2 Q8IXJ6 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
SCHEMBL600052 0.89 THRB (0.56) THRBKDM4EALDH1A1MAPTHPGD
SCHEMBL16554939 0.82 THRB (0.42) THRBKDM4EALDH1A1MAPTHPGD
SCHEMBL2953498 0.80 ALDH1A1 (0.50) THRBKDM4EALDH1A1HPGDTSHR
SCHEMBL1667181 0.79 THRB (0.52) THRBKDM4EALDH1A1MAPTHPGD
SCHEMBL31676719 0.79 KDM4E (0.56) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL3456805 0.79 KDM4E (0.56) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL466296 0.79 KDM4E (0.54) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL2174138 0.78 KDM4E (0.50) THRBKDM4EALDH1A1MAPTHPGD
SCHEMBL6999515 0.78 KDM4E (0.45) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL3502815 0.78 THRB (0.46) THRBKDM4EALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0142241-A1 Dihydroxybenzamide derivatives having anti-inflammatory activity KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-05-22 EP claimed
US-5140020-A Antiinflammatory agents KUREHA KAGATU KOGYO KABUSHIKI KAISHA (JP) 1992-08-18 US disclosed
US-4725598-A Derivative of dihydroxybenzamide and a pharmaceutical composition having an anti-inflammatory activity KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-02-16 US disclosed
EP-0142241-B1 DIHYDROXYBENZAMIDE DERIVATIVES HAVING ANTI-INFLAMMATORY ACTIVITY KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-12-02 EP disclosed
EP-0142241-A1 Dihydroxybenzamide derivatives having anti-inflammatory activity KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-05-22 EP disclosed