SCHEMBL8639756

SCHEMBL8639756

CCOc1c(OC)cc(C=CC(=O)O)cc1OC

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.73
ALDH1A1 P00352 6/20 0.73
HPGD P15428 3/20 0.73
HSD17B10 Q99714 2/20 0.73
HTR1A P08908 1/20 0.73
HTR2C P28335 1/20 0.73
PKM P14618 2/20 0.64
PTGS1 P23219 1/20 0.64
PTGS2 P35354 1/20 0.64
CYP1A1 P04798 3/20 0.64
CYP1A2 P05177 3/20 0.64
CYP2D6 P10635 3/20 0.64
CYP1B1 Q16678 3/20 0.64
SMN1; SMN2 Q16637 3/20 0.58
ALOX15 P16050 1/20 0.58
MAPK1 P28482 1/20 0.58
LMNA P02545 1/20 0.58
MAPT P10636 1/20 0.58
GAA P10253 3/20 0.56
HTT P42858 3/20 0.55

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
SCHEMBL8639752 1.00 KDM4E (0.73) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL23424127 0.90 CYP1A1 (0.62) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL13168898 0.89 KDM4E (0.76) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL11226250 0.88 KDM4E (0.71) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL11226247 0.88 KDM4E (0.71) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL13168900 0.88 KDM4E (0.73) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL14038906 0.88 GAA (0.73) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL14038898 0.86 CYP1A1 (0.62) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL13168901 0.86 KDM4E (0.71) KDM4EALDH1A1HPGDHSD17B10HTR1A
SCHEMBL13168904 0.86 KDM4E (0.71) KDM4EALDH1A1HPGDHSD17B10HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0855387-A1 2-ACYLAMINOBENZAMIDE DERIVATIVES AND PREVENTIVE AND REMEDY FOR DISEASES CAUSED BY THE SUPERMULTIPLICATION OF VASCULAR INTIMAL CELLS KISSEI PHARMACEUTICAL CO., LTD. (JP) 1998-07-29 EP disclosed
US-4337270-A ANTIALLERGENS; ANTIANAPHYLACTIC AGENTS HISAMITSU PHARMACEUTICAL CO., INC. (JP) 1982-06-29 US disclosed