SCHEMBL10492007

SCHEMBL10492007

CCCCCCCC/C=C\CCCCCCCCOCC(CO)OCCCCCCCC

nearest known ligand 0.81

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.71
CNR2 P34972 2/20 0.71
ALDH1A1 P00352 1/20 0.71
LPAR1 Q92633 6/20 0.56
LPAR3 Q9UBY5 6/20 0.56
USP2 O75604 1/20 0.53
LPAR2 Q9HBW0 1/20 0.51

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
SCHEMBL1145371 1.00 CNR1 (0.71) CNR1CNR2ALDH1A1LPAR1LPAR3
SCHEMBL624772 1.00 CNR1 (0.71) CNR1CNR2ALDH1A1LPAR1LPAR3
SCHEMBL10492144 1.00 CNR1 (0.71) CNR1CNR2ALDH1A1LPAR1LPAR3
SCHEMBL10492037 1.00 CNR1 (0.71) CNR1CNR2ALDH1A1LPAR1LPAR3
SCHEMBL13691755 1.00 CNR1 (0.71) CNR1CNR2ALDH1A1LPAR1LPAR3
SCHEMBL10492075 1.00 CNR1 (0.71) CNR1CNR2ALDH1A1LPAR1LPAR3
SCHEMBL24208055 1.00 CNR1 (0.71) CNR1CNR2ALDH1A1LPAR1LPAR3
SCHEMBL16086106 1.00 CNR1 (0.71) CNR1CNR2ALDH1A1LPAR1LPAR3
SCHEMBL7202722 1.00 CNR1 (0.71) CNR1CNR2ALDH1A1LPAR1LPAR3
SCHEMBL30896105 1.00 CNR1 (0.71) CNR1CNR2ALDH1A1LPAR1LPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4845028-A 1,2-DIGLYCERIDE, NONIONIC SURFACTANT TOYO JOZO KABUSHIKI KAISHA (JP) 1989-07-04 US disclosed