SCHEMBL9294402

SCHEMBL9294402

CCCCCCCCCCCCCCCCOC(=O)COS(=O)(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.58
RAD52 P43351 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
FAAH O00519 1/20 0.49
DGKA P23743 1/20 0.48
HTR2C P28335 1/20 0.47
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46
EPHX1 P07099 1/20 0.46
TSHR P16473 2/20 0.44
CA1 P00915 5/20 0.44
CA2 P00918 5/20 0.44
CA9 Q16790 5/20 0.44
CA12 O43570 1/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44

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
SCHEMBL9294068 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL9295463 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL9294803 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL9294073 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL9294205 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL9294335 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL9294753 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL4850175 1.00 NAAA (0.58) NAAARAD52NPSR1FAAHDGKA
SCHEMBL9295444 0.93 NAAA (0.47) NAAARAD52NPSR1FAAHDGKA
SCHEMBL17469815 0.85 CA1 (0.37) NAAARAD52NPSR1DGKATSHR

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-5366665-A Soap bars, cleaning compounds, shampoo and conditioners, cosmetics, dental compositions or deodorant/antiperspirants LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1994-11-22 US disclosed
EP-0530866-A1 Alkyl sulphooxyalkanoate compounds and compositions UNILEVER N.V. (NL) 1993-03-10 EP disclosed