SCHEMBL9397758

SCHEMBL9397758

CC/C=C(\C(C)=O)C(=O)OC

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.43
ALDH1A1 P00352 2/20 0.37
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
TET2 Q6N021 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL9397761 1.00 GLO1 (0.43) GLO1ALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL5918757 0.88 ALDH1A1 (0.36) GLO1ALDH1A1TET2EGLN1MAPT
SCHEMBL10456521 0.82 EP300 (0.38) ALDH1A1TET2EGLN1
SCHEMBL4147576 0.80 GLO1 (0.69) GLO1ALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL4147579 0.80 GLO1 (0.69) GLO1ALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL11720316 0.80 GLO1 (0.42) GLO1ALDH1A1LMNA
SCHEMBL8099809 0.78 EP300 (0.53) GLO1CYP3A4CYP2C9CYP2C19
SCHEMBL7792307 0.78 EP300 (0.53) GLO1CYP3A4CYP2C9CYP2C19
SCHEMBL7104542 0.77 MAPT (0.32) ALDH1A1MAPTNPSR1
SCHEMBL7104544 0.77 MAPT (0.32) ALDH1A1MAPTNPSR1

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
US-5298619-A Platelet activating factor, antiinflammatory agents, allergens and for immunodeficient syndromes ALTER, S.A. (ES) 1994-03-29 US disclosed
EP-0531598-A1 1,4-Dihydropyridines with paf-antagonistic activity ALTER, S.A. (ES) 1993-03-17 EP disclosed