SCHEMBL8625588

SCHEMBL8625588

CCCCCCCCCCCC(N)(OC(CC)CC(C)O)OC(CC)CC(C)O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 5/20 0.42
FDPS P14324 2/20 0.35
SPHK1 Q9NYA1 1/20 0.33
MAPT P10636 1/20 0.33
S1PR2 O95136 1/20 0.31
S1PR4 O95977 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
S1PR5 Q9H228 1/20 0.31
HTT P42858 1/20 0.30
GGPS1 O95749 1/20 0.30

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
SCHEMBL8628260 1.00 SMPD1 (0.42) SMPD1FDPSSPHK1MAPTS1PR2
SCHEMBL8626991 1.00 SMPD1 (0.42) SMPD1FDPSSPHK1MAPTS1PR2
SCHEMBL7228670 1.00 SMPD1 (0.42) SMPD1FDPSSPHK1MAPTS1PR2
SCHEMBL7235752 0.92 SMPD1 (0.37) SMPD1SPHK1MAPT
SCHEMBL8627394 0.83 SMPD1 (0.45) SMPD1FDPSSPHK1MAPTS1PR2
SCHEMBL8629776 0.80 SMPD1 (0.45) SMPD1FDPSSPHK1MAPTS1PR2
SCHEMBL8624535 0.76 SMPD1 (0.39) SMPD1SPHK1MAPT
SCHEMBL7235757 0.73 FAAH (0.42) MAPT
SCHEMBL8628402 0.73 CNR2 (0.39) SMPD1SPHK1MAPT
SCHEMBL7237838 0.70 SMPD1 (0.45) SMPD1FDPSSPHK1GGPS1

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-0276501-B2 Thickening compositions and thickened aqueous acid solutions AKZO NOBEL NV (NL) 1998-06-17 EP disclosed
US-5041239-A Premix compositions for the preparation of thickened aqueous acid solutions AKZO N. V. (NL) 1991-08-20 US disclosed
US-4853146-A Thickening compositions and thickened aqueous acid solutions AKZO N.V. (NL) 1989-08-01 US disclosed
EP-0276501-A2 Thickening compositions and thickened aqueous acid solutions Akzo Nobel N.V. (NL) 1988-08-03 EP disclosed