SCHEMBL13112688

SCHEMBL13112688

CCCCCCCC(=O)O[C@H](COP=O)COC(=O)CCCCCCCS

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.69
LMNA P02545 1/20 0.69
LPAR3 Q9UBY5 7/20 0.61
LPAR1 Q92633 4/20 0.61
ENPP2 Q13822 3/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
PRKCA P17252 4/20 0.60
PRKCE Q02156 2/20 0.60
PRKCQ Q04759 2/20 0.60
PRKCD Q05655 2/20 0.60
LPAR2 Q9HBW0 2/20 0.56
SMPD1 P17405 1/20 0.49

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
SCHEMBL13112571 1.00 ALDH1A1 (0.69) ALDH1A1LMNALPAR3LPAR1ENPP2
SCHEMBL13112701 1.00 ALDH1A1 (0.69) ALDH1A1LMNALPAR3LPAR1ENPP2
SCHEMBL13112602 1.00 ALDH1A1 (0.69) ALDH1A1LMNALPAR3LPAR1ENPP2
SCHEMBL13112600 1.00 ALDH1A1 (0.69) ALDH1A1LMNALPAR3LPAR1ENPP2
SCHEMBL13112603 1.00 ALDH1A1 (0.69) ALDH1A1LMNALPAR3LPAR1ENPP2
SCHEMBL13112591 1.00 ALDH1A1 (0.69) ALDH1A1LMNALPAR3LPAR1ENPP2
SCHEMBL13112690 1.00 ALDH1A1 (0.69) ALDH1A1LMNALPAR3LPAR1ENPP2
SCHEMBL13112575 1.00 ALDH1A1 (0.69) ALDH1A1LMNALPAR3LPAR1ENPP2
SCHEMBL13112686 1.00 ALDH1A1 (0.69) ALDH1A1LMNALPAR3LPAR1ENPP2
SCHEMBL13112576 1.00 ALDH1A1 (0.69) ALDH1A1LMNALPAR3LPAR1ENPP2

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-7820803-B2 Immobilized phosphatidic acid probe Holmes, Andrew Bruce (GB) 2010-10-26 US disclosed