SCHEMBL3628634

SCHEMBL3628634

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCC)OP(=O)(O)CCCCCCCCCCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.55
S1PR2 O95136 5/20 0.51
S1PR1 P21453 5/20 0.51
S1PR3 Q99500 5/20 0.51
S1PR4 O95977 4/20 0.51
PLA2G2C Q5R387 1/20 0.51
FDPS P14324 4/20 0.50
LPAR3 Q9UBY5 3/20 0.50
LPAR2 Q9HBW0 1/20 0.50
LAP3 P28838 1/20 0.47
CETP P11597 1/20 0.45

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
SCHEMBL8862377 1.00 SMPD1 (0.55) SMPD1S1PR2S1PR1S1PR3S1PR4
SCHEMBL17729115 0.96 SMPD1 (0.50) SMPD1S1PR2S1PR1S1PR3S1PR4
SCHEMBL11758313 0.86 SMPD1 (0.45) SMPD1S1PR2S1PR1S1PR3S1PR4
SCHEMBL3617544 0.86 PLA2G2C (0.49) SMPD1S1PR2S1PR1S1PR3S1PR4
SCHEMBL6354042 0.85 FDPS (0.44) SMPD1S1PR2S1PR1S1PR3S1PR4
SCHEMBL1737858 0.82 SMPD1 (0.71) SMPD1S1PR2S1PR1S1PR3S1PR4
SCHEMBL6553497 0.82 SMPD1 (0.71) SMPD1S1PR2S1PR1S1PR3S1PR4
SCHEMBL1260906 0.82 SMPD1 (0.71) SMPD1S1PR2S1PR1S1PR3S1PR4
SCHEMBL11371195 0.82 SMPD1 (0.71) SMPD1S1PR2S1PR1S1PR3S1PR4
SCHEMBL9437002 0.82 SMPD1 (0.71) SMPD1S1PR2S1PR1S1PR3S1PR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1544279-B1 LUBRICATING COMPOSITION NIPPON OIL CORP (JP) 2016-09-28 EP disclosed
US-7696137-B2 Lubricating oil compositions NIPPON OIL CORPORATION (JP) 2010-04-13 US disclosed
US-20050143266-A1 Lubricating oil compositions NIPPON OIL CORPORATION 2005-06-30 US disclosed
EP-1544279-A1 LUBRICATING COMPOSITION Nippon Oil Corporation (JP) 2005-06-22 EP disclosed