SCHEMBL27832005

SCHEMBL27832005

CCCCCCCCCC(CCCCCCCC(=O)OC)OP(=O)(O)C(CCCCCCCCC)CCCCCCCC(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 9/20 0.46
SMPD1 P17405 3/20 0.43
PPARG P37231 1/20 0.43
PLA2G4A P47712 1/20 0.42
LPAR3 Q9UBY5 6/20 0.42
LPAR1 Q92633 5/20 0.42
LPAR6 P43657 3/20 0.42
LPAR4 Q99677 3/20 0.42
LPAR5 Q9H1C0 3/20 0.42
LPAR2 Q9HBW0 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL27832006 0.85 ENPP2 (0.42) ENPP2SMPD1PPARGPLA2G4ALPAR3
SCHEMBL12083477 0.84 ENPP2 (0.48) ENPP2SMPD1PPARGPLA2G4ALPAR3
SCHEMBL98154 0.84 ENPP2 (0.48) ENPP2SMPD1PPARGPLA2G4ALPAR3
SCHEMBL8845204 0.79 MAPT (0.51) ENPP2PPARGLPAR3LPAR1LPAR6
SCHEMBL8457540 0.79 MAPT (0.51) ENPP2PPARGLPAR3LPAR1LPAR6
SCHEMBL15265832 0.77 SMPD1 (0.47) SMPD1LPAR3LPAR1
SCHEMBL4816271 0.77 MAPK1 (0.64)
SCHEMBL17694565 0.77 MAPK1 (0.64)
SCHEMBL17694568 0.77 MAPK1 (0.64)
SCHEMBL14681890 0.77 ENPP2 (0.54) ENPP2LPAR3LPAR1LPAR6LPAR4

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
CN-102046692-A Solid phase polymerization of polyesters with phosphinic acid compounds BASF SE 2011-05-04 CN disclosed