SCHEMBL9545231

SCHEMBL9545231

O=CC(O)COP(=O)(O)OP(=O)(O)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MPI P34949 1/20 0.46
BTN3A1 O00481 3/20 0.44
LPAR1 Q92633 1/20 0.39
LPAR3 Q9UBY5 1/20 0.39
FNTA P49354 4/20 0.39
PGGT1B P53609 2/20 0.39
FNTB P49356 2/20 0.39
ENPP1 P22413 2/20 0.36
ENPP3 O14638 1/20 0.36
MVD P53602 1/20 0.36

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
SCHEMBL29977872 1.00 MPI (0.46) MPIBTN3A1LPAR1LPAR3FNTA
SCHEMBL1759593 0.96 MPI (0.43) MPIBTN3A1LPAR1LPAR3FNTA
SCHEMBL10709491 0.83 MPI (0.63) MPILPAR1LPAR3
SCHEMBL28125367 0.83 MPI (0.63) MPILPAR1LPAR3
SCHEMBL328992 0.83 MPI (0.63) MPILPAR1LPAR3
SCHEMBL34088 0.83 MPI (0.63) MPILPAR1LPAR3
SCHEMBL1395698 0.83 MPI (0.63) MPILPAR1LPAR3
Phosphoric Acid SCHEMBL6754811 0.81 MPI (0.61) MPILPAR1LPAR3
Phosphoric Acid SCHEMBL17103808 0.81 MPI (0.61) MPILPAR1LPAR3
Ammonia Solution, Strong SCHEMBL28280469 0.81 MPI (0.61) MPILPAR1LPAR3

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
WO-1993020707-A1 ANTI-CAVITY CHEWING GUM AND METHOD OF FIGHTING TOOTH DECAY USING GLYCERALDEHYDE WM. WRIGLEY JR. COMPANY (US) 1993-10-28 WO disclosed