SCHEMBL6810197

SCHEMBL6810197

CCCCCCCCCCCCCCCCCC(=O)NCCN(C)CCOC(=O)CCCCCCCCCCCCCCCCC

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.63
DGKA P23743 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.52
FAAH O00519 5/20 0.50
CASP2 P42575 1/20 0.46
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
NAPEPLD Q6IQ20 1/20 0.45
ENPP2 Q13822 1/20 0.44
LPAR1 Q92633 1/20 0.44
LPAR2 Q9HBW0 1/20 0.44
EPHX2 P34913 1/20 0.44
PAM P19021 1/20 0.44

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
SCHEMBL9549623 0.88 DNM1 (0.80) DNM1FAAHCASP2CNR1CNR2
Hydrochloric Acid SCHEMBL10935086 0.86 DNM1 (0.77) DNM1FAAHCASP2CNR1EPHX2
SCHEMBL17401279 0.86 DNM1 (0.83) DNM1DGKAPAM
SCHEMBL17401274 0.86 DNM1 (0.83) DNM1DGKAPAM
SCHEMBL17401275 0.86 DNM1 (0.83) DNM1DGKAPAM
SCHEMBL14239731 0.86 DNM1 (0.83) DNM1DGKAPAM
SCHEMBL17401277 0.86 DNM1 (0.83) DNM1DGKAPAM
SCHEMBL5343022 0.86 EPHX2 (0.58) DNM1CNR1ENPP2LPAR1LPAR2
SCHEMBL5343029 0.86 EPHX2 (0.58) DNM1CNR1ENPP2LPAR1LPAR2
SCHEMBL8920345 0.85 DGKA (0.67) DNM1DGKAL3MBTL1FAAHCASP2

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-1445303-A2 Liquid softener composition KAO CORPORATION (JP) 2004-08-11 EP disclosed
EP-0707059-A2 Liquid softener composition, use thereof and process for preparing a quaternary ammonium salt KAO CORPORATION (JP) 1996-04-17 EP disclosed