SCHEMBL13616539

SCHEMBL13616539

NC(=O)CCCCCOP(=O)(O)O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LPAR3 Q9UBY5 9/20 0.57
▸ LPAR2 Q9HBW0 8/20 0.57
▸ LPAR1 Q92633 6/20 0.57
▸ ENPP2 Q13822 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ PGD P52209 1/20 0.38
▸ TPI1 P60174 1/20 0.38
▸ LPAR6 P43657 1/20 0.37
▸ LPAR4 Q99677 1/20 0.37
▸ LPAR5 Q9H1C0 1/20 0.37

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
SCHEMBL1650937 0.91 LPAR3 (0.50) LPAR3LPAR2LPAR1PGDTPI1
Urea SCHEMBL28528722 0.86 LPAR3 (0.60) LPAR3LPAR2LPAR1PGDTPI1
SCHEMBL22661363 0.84 PGD (0.42) LPAR3LPAR2LPAR1PGDTPI1
SCHEMBL27042244 0.83 LPAR3 (0.76) LPAR3LPAR2LPAR1LPAR5
SCHEMBL9233772 0.83 LPAR3 (0.76) LPAR3LPAR2LPAR1LPAR5
SCHEMBL28124639 0.83 LPAR3 (0.76) LPAR3LPAR2LPAR1LPAR5
SCHEMBL27042238 0.83 LPAR3 (0.76) LPAR3LPAR2LPAR1LPAR5
SCHEMBL6851142 0.83 LPAR3 (0.76) LPAR3LPAR2LPAR1LPAR5
SCHEMBL6033633 0.83 LPAR3 (0.76) LPAR3LPAR2LPAR1LPAR5
Propyl Phosphate SCHEMBL29926263 0.83 LPAR3 (0.63) LPAR3LPAR2LPAR1ENPP2LPAR6

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-7615221-B2 Compositions and methods for treating cancer ONCOLOGIC, INC. (US) 2009-11-10 — — US disclosed
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