SCHEMBL3179340

SCHEMBL3179340

CCCCCCCCCCCC(=O)N[C@@H]1O[C@H](C(O)C(C)=O)[C@](O)(C(C)=O)[C@@](O)(C(C)=O)[C@]1(O)C(C)=O

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 6/20 0.37
CNR1 P21554 4/20 0.37
CNR2 P34972 4/20 0.37
FAAH O00519 2/20 0.35
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
GNAI3 P08754 1/20 0.34
GNAO1 P09471 1/20 0.34
GNAI1 P63096 1/20 0.34
HSP90AA1 P07900 1/20 0.34
NAAA Q02083 3/20 0.34
EPHX2 P34913 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
SCHEMBL14895407 0.83
SCHEMBL3264160 0.81
SCHEMBL27907232 0.72 CPT2 (0.30)
SCHEMBL6705836 0.69
SCHEMBL3171057 0.68 HPGD (0.36) CNR1CNR2MEN1KMT2A
SCHEMBL878538 0.68 MAPK1 (0.44) MAPK1
SCHEMBL9175639 0.66
SCHEMBL13279909 0.64
SCHEMBL7884756 0.64 OGA (0.34)
SCHEMBL10708871 0.64 OGA (0.34)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7655611-B2 Structural family on non-ionic carbohydrate based surfactants (NICBS) and a novel process for their synthesis THE UNIVERSITY OF HOUSTON SYSTEM (US) 2010-02-02 US disclosed
US-20060154846-A1 Novel structural family on non-ionic carbohydrate based surfactants (NICBS) and a novel process for their synthesis THE UNIVERSITY OF HOUSTON SYSTEM 2006-07-13 US disclosed