SCHEMBL9484333

SCHEMBL9484333

CCCCCCCCC(C)OP(=O)(O)OC(C)CCCCCCCC

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.58
FDPS P14324 5/20 0.53
S1PR2 O95136 5/20 0.50
S1PR1 P21453 5/20 0.50
S1PR3 Q99500 5/20 0.50
S1PR4 O95977 4/20 0.50
LAP3 P28838 2/20 0.50
PTPN1 P18031 1/20 0.46
FAAH O00519 1/20 0.45
LPAR3 Q9UBY5 3/20 0.44
LPAR1 Q92633 2/20 0.44
LPAR2 Q9HBW0 2/20 0.44

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
SCHEMBL329612 1.00 SMPD1 (0.58) SMPD1FDPSS1PR2S1PR1S1PR3
SCHEMBL3797731 1.00 SMPD1 (0.58) SMPD1FDPSS1PR2S1PR1S1PR3
SCHEMBL3821685 1.00 SMPD1 (0.58) SMPD1FDPSS1PR2S1PR1S1PR3
SCHEMBL213777 0.98 SMPD1 (0.56) SMPD1FDPSS1PR2S1PR1S1PR3
SCHEMBL673087 0.98 SMPD1 (0.56) SMPD1FDPSS1PR2S1PR1S1PR3
SCHEMBL672989 0.98 SMPD1 (0.56) SMPD1FDPSS1PR2S1PR1S1PR3
SCHEMBL4609034 0.98 SMPD1 (0.56) SMPD1FDPSS1PR2S1PR1S1PR3
SCHEMBL4260343 0.98 SMPD1 (0.56) SMPD1FDPSS1PR2S1PR1S1PR3
SCHEMBL3813612 0.98 SMPD1 (0.55) SMPD1FDPSS1PR2S1PR1S1PR3
SCHEMBL3823543 0.92 FDPS (0.50) SMPD1FDPSS1PR2S1PR1S1PR3

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-5258167-A Extractant for rare earth metal and method for extracting the same LION CORPORATION (JP) 1993-11-02 US disclosed