SCHEMBL10448155

SCHEMBL10448155

CCCCC(=O)OC(C)=O.CCCCC(=O)OC(C)=O.CCCCC(=O)OC(C)=O.[Al]

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
CES1 P23141 2/20 0.46
CES2 O00748 1/20 0.46
DGKA P23743 1/20 0.45
TP53 P04637 1/20 0.42
LMNA P02545 2/20 0.42
TSHR P16473 1/20 0.41
CA1 P00915 1/20 0.41
PAM P19021 2/20 0.41
NAAA Q02083 1/20 0.40
PRKCA P17252 2/20 0.40
MAPT P10636 1/20 0.39
MAPK1 P28482 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
SCHEMBL50168 0.98 ALDH1A1 (0.52) ALDH1A1CES1CES2DGKATP53
SCHEMBL8603407 0.93 DGKA (0.54) ALDH1A1CES1CES2DGKALMNA
SCHEMBL6276582 0.91 DGKA (0.57) ALDH1A1CES1CES2DGKALMNA
SCHEMBL1238292 0.91 DGKA (0.56) ALDH1A1CES1CES2DGKALMNA
SCHEMBL28412264 0.91 ALDH1A1 (0.56) ALDH1A1CES1CES2DGKATP53
SCHEMBL1698285 0.88 DGKA (0.59) ALDH1A1CES1CES2DGKALMNA
SCHEMBL2235744 0.88 DGKA (0.59) ALDH1A1CES1CES2DGKALMNA
SCHEMBL22126637 0.88 DGKA (0.59) ALDH1A1CES1CES2DGKALMNA
SCHEMBL21831925 0.88 DGKA (0.54) ALDH1A1CES1CES2DGKALMNA
SCHEMBL20482068 0.88 DGKA (0.54) ALDH1A1CES1CES2DGKALMNA

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-0358153-A2 Automotive coating compositions KANSAI PAINT CO., LTD. (JP) 1990-03-14 EP disclosed
EP-0358238-A2 Resin compositions and a method of curing the same KANSAI PAINT CO., LTD. (JP) 1990-03-14 EP disclosed