SCHEMBL9879477

SCHEMBL9879477

O=P(O)(O)OCCN(CCOP(=O)(O)O)CCN(CCOP(=O)(O)O)CCOP(=O)(O)O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 8/20 0.43
LPAR2 Q9HBW0 6/20 0.43
LPAR1 Q92633 4/20 0.43
MVD P53602 1/20 0.36
TPI1 P60174 2/20 0.34
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
FBP1 P09467 1/20 0.32
FDPS P14324 1/20 0.32
BLM P54132 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL946310 0.97 LPAR3 (0.44) LPAR3LPAR2LPAR1MVDTPI1
SCHEMBL2349790 0.95 LPAR3 (0.43) LPAR3LPAR2LPAR1MVDTPI1
SCHEMBL2802305 0.88 LPAR3 (0.39) LPAR3LPAR2LPAR1MVDTPI1
SCHEMBL13531692 0.88 LPAR3 (0.43) LPAR3LPAR2LPAR1MVDTPI1
SCHEMBL16011643 0.88 LPAR3 (0.39) LPAR3LPAR2LPAR1MVDTPI1
SCHEMBL1462880 0.86 LPAR3 (0.38) LPAR3LPAR2LPAR1MVDTPI1
SCHEMBL21409643 0.83 LPAR3 (0.48) LPAR3LPAR2LPAR1MVDBLM
SCHEMBL10992277 0.83 LPAR3 (0.44) LPAR3LPAR2LPAR1MVD
SCHEMBL28355254 0.83 LPAR3 (0.59) LPAR3LPAR2LPAR1FDPS
SCHEMBL3427350 0.81 LPAR3 (0.38) LPAR3LPAR2LPAR1MVD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0429442-A4 DENTAL THERAPY BY VESICLE DELIVERY 1991-07-03 EP disclosed
EP-0429442-A1 DENTAL THERAPY BY VESICLE DELIVERY. TECHNOLOGY UNLIMITED INC (US) 1991-06-05 EP disclosed
WO-1990001923-A1 DENTAL THERAPY BY VESICLE DELIVERY TECHNOLOGY UNLIMITED, INC. (US) 1990-03-08 WO disclosed