SCHEMBL9743191

SCHEMBL9743191

CCCOC(=O)CC(CC)OC(=O)CC

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.41
MEN1 O00255 1/20 0.41
CYP2C19 P33261 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 4/20 0.35
LMNA P02545 1/20 0.35
PRKCA P17252 2/20 0.34
MAPT P10636 2/20 0.33
MAPK1 P28482 2/20 0.33
DGKA P23743 1/20 0.33
PRKCE Q02156 1/20 0.33
PRKCQ Q04759 1/20 0.33
PRKCD Q05655 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL9744415 0.89 NAAA (0.52) NAAAMEN1CYP2C19RECQLKMT2A
SCHEMBL9743139 0.88 NAAA (0.59) NAAAALDH1A1LMNAPRKCAMAPT
SCHEMBL9743328 0.87 ALDH1A1 (0.41) MEN1KMT2AALDH1A1LMNAPRKCA
SCHEMBL9743223 0.87 ALDH1A1 (0.41) MEN1KMT2AALDH1A1LMNAPRKCA
SCHEMBL25179797 0.87 NAAA (0.40) NAAAMEN1CYP2C19RECQLKMT2A
SCHEMBL24952595 0.86 MEN1 (0.39) NAAAMEN1CYP2C19RECQLKMT2A
SCHEMBL9742799 0.85 PRKCA (0.41) NAAAMEN1KMT2AALDH1A1LMNA
SCHEMBL9743654 0.85 MEN1 (0.43) MEN1CYP2C19RECQLKMT2AALDH1A1
SCHEMBL9743208 0.84 LMNA (0.50) MEN1KMT2AALDH1A1LMNAPRKCA
SCHEMBL13221940 0.84 MAPT (0.41) MEN1KMT2AALDH1A1LMNAPRKCA

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-5128252-A Resolution of optically active esters, transesterification, lipase CHISSO CORPORATION (JP) 1992-07-07 US disclosed
EP-0384189-A2 Optically active compound and a process for the production thereof CHISSO CORPORATION (JP) 1990-08-29 EP disclosed