SCHEMBL8024144

SCHEMBL8024144

CCCCCCCCCCCC(=O)O[C@H](CC)C(C)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.61
MAPT P10636 5/20 0.53
MAPK1 P28482 5/20 0.53
ALDH1A1 P00352 1/20 0.50
GMNN O75496 3/20 0.47
NPSR1 Q6W5P4 3/20 0.47
CYP1A2 P05177 2/20 0.47
MEN1 O00255 2/20 0.47
HSP90AA1 P07900 2/20 0.47
BLM P54132 2/20 0.47
KMT2A Q03164 2/20 0.47
NR1H4 Q96RI1 2/20 0.47
TP53 P04637 1/20 0.47
CYP2C9 P11712 1/20 0.47
TSHR P16473 1/20 0.47
HIF1A Q16665 1/20 0.47
PRKCA P17252 1/20 0.46
PRKCE Q02156 1/20 0.46
PRKCQ Q04759 1/20 0.46
PRKCD Q05655 1/20 0.46

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
SCHEMBL10053675 0.86 LMNA (0.68) LMNAMAPTMAPK1ALDH1A1GMNN
SCHEMBL10053686 0.84 LMNA (0.64) LMNAMAPTMAPK1ALDH1A1GMNN
SCHEMBL9730000 0.83 LMNA (0.65) LMNAMAPTMAPK1ALDH1A1MEN1
SCHEMBL8007187 0.83 LMNA (0.65) LMNAMAPTMAPK1ALDH1A1GMNN
SCHEMBL9730544 0.83 LMNA (0.65) LMNAMAPTMAPK1ALDH1A1MEN1
SCHEMBL29174017 0.81 LMNA (0.62) LMNAMAPTMAPK1ALDH1A1GMNN
SCHEMBL17437789 0.81 LMNA (0.62) LMNAMAPTMAPK1ALDH1A1GMNN
SCHEMBL9730330 0.81 LMNA (0.61) LMNAMAPTMAPK1ALDH1A1MEN1
SCHEMBL14666487 0.79 LMNA (0.59) LMNAMAPTMAPK1ALDH1A1GMNN
SCHEMBL10027719 0.79 LMNA (0.59) LMNAMAPTMAPK1ALDH1A1GMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0774452-B1 Optically active compounds having plural chiral centers and the production thereof CHISSO CORP (JP) 2000-01-26 EP disclosed
EP-0428392-B1 Processes for the preparation of optically active compounds having plural chiral centers CHISSO CORP (JP) 1998-05-27 EP disclosed
EP-0774452-A1 Optically active compounds having plural chiral centers and the production thereof Chisso Corporation (JP) 1997-05-21 EP disclosed
US-5574182-A HYDROLYSING 3-HYDROXYCARBOXYLIC ACID, CYCLIZING ESTER TO FORM 1,3-DIOXAN-4-ONE, DECYCLIZATION AND ESTERIFICATION CHISSO CORPORATION (JP) 1996-11-12 US disclosed
US-5411877-A Esterification CHISSO CORPORATION (JP) 1995-05-02 US disclosed
US-5348870-A Using hydrolase to effect ester interchange and resolution, then alcoholysis or hydrolysis and dehydration with cyclization and crystallization CHISSO CORPORATION (JP) 1994-09-20 US disclosed
EP-0428392-A2 Optically active compounds having plural chiral centers and the production thereof Chisso Corporation (JP) 1991-05-22 EP disclosed