SCHEMBL8971883

SCHEMBL8971883

CCCCCCCC/C=C/C(O)CCC(=O)OCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.52
FAAH O00519 3/20 0.51
ALDH1A1 P00352 1/20 0.50
CYP3A4 P08684 1/20 0.50
ALOX15 P16050 1/20 0.50
TSHR P16473 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PPARG P37231 2/20 0.49
GPR132 Q9UNW8 1/20 0.49
LPAR1 Q92633 5/20 0.47
ENPP2 Q13822 2/20 0.47
LPAR4 Q99677 2/20 0.47
LPAR5 Q9H1C0 2/20 0.47
LPAR2 Q9HBW0 2/20 0.47
LPAR3 Q9UBY5 2/20 0.47
CES2 O00748 1/20 0.47
LPAR6 P43657 1/20 0.47
TRPV1 Q8NER1 1/20 0.47
PRKCE Q02156 1/20 0.47

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
SCHEMBL8971889 1.00 DGKA (0.52) DGKAFAAHALDH1A1CYP3A4ALOX15
SCHEMBL6137294 0.90 ALDH1A1 (0.56) DGKAFAAHALDH1A1CYP3A4ALOX15
SCHEMBL6137284 0.90 ALDH1A1 (0.56) DGKAFAAHALDH1A1CYP3A4ALOX15
SCHEMBL6137304 0.90 ALDH1A1 (0.56) DGKAFAAHALDH1A1CYP3A4ALOX15
SCHEMBL6386545 0.90 ALDH1A1 (0.56) DGKAFAAHALDH1A1CYP3A4ALOX15
SCHEMBL6137276 0.90 ALDH1A1 (0.56) DGKAFAAHALDH1A1CYP3A4ALOX15
SCHEMBL6137407 0.90 ALDH1A1 (0.56) DGKAFAAHALDH1A1CYP3A4ALOX15
SCHEMBL6137412 0.90 ALDH1A1 (0.56) DGKAFAAHALDH1A1CYP3A4ALOX15
SCHEMBL6137416 0.90 ALDH1A1 (0.56) DGKAFAAHALDH1A1CYP3A4ALOX15
SCHEMBL6386552 0.90 ALDH1A1 (0.56) DGKAFAAHALDH1A1CYP3A4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0435293-B1 Methods of producing optically active hydroxyesters NITTO DENKO CORP (JP) 1996-03-20 EP disclosed
US-5272069-A Method of producing optically active hydroxyesters NITTO DENKO CO. LTD. (JP) 1993-12-21 US disclosed
EP-0435293-A2 Methods of producing optically active hydroxyesters Nitto Denko Co. Ltd. (JP) 1991-07-03 EP disclosed