SCHEMBL8629776

SCHEMBL8629776

CCCCCCCCCCCCCCCC(N)(OC(CC)CCO)OC(CC)CCO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.45
FDPS P14324 2/20 0.37
LMNA P02545 4/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.35
CYP2D6 P10635 2/20 0.33
MAPT P10636 2/20 0.33
HTT P42858 2/20 0.33
SPHK1 Q9NYA1 1/20 0.33
GMNN O75496 1/20 0.33
POLB P06746 1/20 0.33
THPO P40225 1/20 0.33
MTOR P42345 1/20 0.33
BLM P54132 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL8628402 0.91 CNR2 (0.39) SMPD1LMNAMEN1KMT2AALDH1A1
SCHEMBL8624672 0.83 SMPD1 (0.45) SMPD1FDPSLMNAMEN1KMT2A
SCHEMBL8628258 0.83 SMPD1 (0.45) SMPD1FDPSLMNAMEN1KMT2A
SCHEMBL7237838 0.83 SMPD1 (0.45) SMPD1FDPSLMNAMEN1KMT2A
SCHEMBL7238646 0.83 SMPD1 (0.45) SMPD1FDPSLMNAMEN1KMT2A
SCHEMBL8628260 0.80 SMPD1 (0.42) SMPD1FDPSMAPTHTTSPHK1
SCHEMBL7228670 0.80 SMPD1 (0.42) SMPD1FDPSMAPTHTTSPHK1
SCHEMBL8626991 0.80 SMPD1 (0.42) SMPD1FDPSMAPTHTTSPHK1
SCHEMBL8625588 0.80 SMPD1 (0.42) SMPD1FDPSMAPTHTTSPHK1
SCHEMBL7228897 0.75 CNR1 (0.39) SMPD1LMNAMEN1KMT2ACYP2D6

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 claimed
EP-0276501-A2 Thickening compositions and thickened aqueous acid solutions Akzo Nobel N.V. (NL) 1988-08-03 EP claimed
EP-0276501-B2 Thickening compositions and thickened aqueous acid solutions AKZO NOBEL NV (NL) 1998-06-17 EP disclosed
EP-0276501-A2 Thickening compositions and thickened aqueous acid solutions Akzo Nobel N.V. (NL) 1988-08-03 EP disclosed