SCHEMBL8628258

SCHEMBL8628258

CCCCCCCCCCCCCC(N)(OC(C)CCO)OC(C)CCO

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.45
FDPS P14324 8/20 0.37
OPRM1 P35372 1/20 0.36
LMNA P02545 3/20 0.35
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.35
SPHK1 Q9NYA1 1/20 0.35
GGPS1 O95749 3/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL7237838 1.00 SMPD1 (0.45) SMPD1FDPSOPRM1LMNAALDH1A1
SCHEMBL8624672 1.00 SMPD1 (0.45) SMPD1FDPSOPRM1LMNAALDH1A1
SCHEMBL7238646 1.00 SMPD1 (0.45) SMPD1FDPSOPRM1LMNAALDH1A1
SCHEMBL7228897 0.91 CNR1 (0.39) SMPD1LMNAMEN1KMT2ASPHK1
SCHEMBL8629776 0.83 SMPD1 (0.45) SMPD1FDPSOPRM1LMNAALDH1A1
SCHEMBL8627394 0.79 SMPD1 (0.45) SMPD1FDPSSPHK1GGPS1
SCHEMBL8628402 0.75 CNR2 (0.39) SMPD1LMNAALDH1A1MEN1KMT2A
SCHEMBL8624535 0.72 SMPD1 (0.39) SMPD1LMNAALDH1A1MEN1KMT2A
SCHEMBL9682320 0.71 SMPD1 (0.50) SMPD1FDPSLMNAALDH1A1HSD17B10
SCHEMBL28066724 0.71 SMPD1 (0.50) SMPD1FDPSLMNAALDH1A1HSD17B10

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