SCHEMBL8628402

SCHEMBL8628402

CCCCCCCC/C=C\CCCCCCCC(N)(OC(CC)CCO)OC(CC)CCO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.39
ALDH1A1 P00352 2/20 0.39
CNR1 P21554 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
SMPD1 P17405 2/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
TP53 P04637 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
FAAH O00519 1/20 0.38
CYP3A4 P08684 1/20 0.38
SOAT1 P35610 1/20 0.38
MAPT P10636 3/20 0.37
GMNN O75496 2/20 0.37
LMNA P02545 2/20 0.37
GLA P06280 2/20 0.37
POLB P06746 2/20 0.37
THRB P10828 2/20 0.37
CETP P11597 2/20 0.37

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
SCHEMBL8629776 0.91 SMPD1 (0.45) ALDH1A1SMPD1MEN1KMT2ATP53
SCHEMBL7228897 0.86 CNR1 (0.39) CNR2CNR1TRPV1SMPD1MEN1
SCHEMBL7235752 0.83 SMPD1 (0.37) CNR2ALDH1A1CNR1SMPD1MEN1
SCHEMBL8628409 0.81 FAAH (0.44) CNR2ALDH1A1CNR1TRPV1MEN1
SCHEMBL8628258 0.75 SMPD1 (0.45) ALDH1A1SMPD1MEN1KMT2ATP53
SCHEMBL8624672 0.75 SMPD1 (0.45) ALDH1A1SMPD1MEN1KMT2ATP53
SCHEMBL7238646 0.75 SMPD1 (0.45) ALDH1A1SMPD1MEN1KMT2ATP53
SCHEMBL7237838 0.75 SMPD1 (0.45) ALDH1A1SMPD1MEN1KMT2ATP53
SCHEMBL8624535 0.74 SMPD1 (0.39) ALDH1A1SMPD1MEN1KMT2ATP53
SCHEMBL8628405 0.74 CNR2 (0.43) CNR2ALDH1A1CNR1TRPV1SMPD1

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