SCHEMBL9813016

SCHEMBL9813016

NC/C=C/c1cccc(OCC(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
PPARG P37231 4/20 0.52
PPARA Q07869 4/20 0.52
ACMSD Q8TDX5 1/20 0.51
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
PTPN7 P35236 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALOX15 P16050 1/20 0.50
EPOR P19235 2/20 0.49
PKM P14618 1/20 0.48
MAPK1 P28482 1/20 0.45
ALOX5 P09917 1/20 0.44
ALOX5AP P20292 1/20 0.44
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
GRIK1 P39086 1/20 0.43
GRIK2 Q13002 1/20 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
SCHEMBL9813018 1.00 LMNA (0.53) LMNAPPARGPPARAACMSDKDM4E
SCHEMBL3175679 0.87 LMNA (0.54) LMNAPPARGPPARAACMSDKDM4E
SCHEMBL3175689 0.87 LMNA (0.54) LMNAPPARGPPARAACMSDKDM4E
SCHEMBL3165159 0.85 LMNA (0.53) LMNAPPARGPPARAACMSDKDM4E
SCHEMBL3165146 0.85 LMNA (0.53) LMNAPPARGPPARAACMSDKDM4E
SCHEMBL4683421 0.85 LMNA (0.53) LMNAPPARGPPARAACMSDKDM4E
SCHEMBL14143474 0.85 KDM4E (0.57) LMNAPPARGPPARAACMSDKDM4E
SCHEMBL4683425 0.85 LMNA (0.53) LMNAPPARGPPARAACMSDKDM4E
SCHEMBL4683688 0.81 CCNB2 (0.65) LMNAPPARGPPARAACMSDKDM4E
SCHEMBL4683690 0.81 CCNB2 (0.65) LMNAPPARGPPARAACMSDKDM4E

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-0223593-B1 PHENOXYALKYLCARBOXYLIC ACIDS AND ESTERS AND THEIR PREPARATION AND PHARMACEUTICAL FORMULATION GLAXO GROUP LIMITED (GB) 1991-08-07 EP disclosed
EP-0223593-A2 Phenoxyalkylcarboxylic acids and esters and their preparation and pharmaceutical formulation GLAXO GROUP LIMITED (GB) 1987-05-27 EP disclosed