SCHEMBL9294163

SCHEMBL9294163

CCCCCCCCCCCCCCOC(=O)CC(OS(=O)(=O)O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.49
NPSR1 Q6W5P4 2/20 0.43
RAD52 P43351 1/20 0.43
FAAH O00519 2/20 0.42
DGKA P23743 1/20 0.41
HTR2C P28335 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HCAR2 Q8TDS4 2/20 0.40
EPHX1 P07099 1/20 0.39
TSHR P16473 2/20 0.38
NOD1 Q9Y239 1/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38

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
SCHEMBL9295177 1.00 NAAA (0.49) NAAANPSR1RAD52FAAHDGKA
SCHEMBL9294434 1.00 NAAA (0.49) NAAANPSR1RAD52FAAHDGKA
SCHEMBL9294252 1.00 NAAA (0.49) NAAANPSR1RAD52FAAHDGKA
SCHEMBL9294022 0.90 NAAA (0.50) NAAANPSR1RAD52FAAHDGKA
SCHEMBL9295281 0.90 NAAA (0.50) NAAANPSR1RAD52FAAHDGKA
SCHEMBL9294973 0.90 NAAA (0.50) NAAANPSR1RAD52FAAHDGKA
SCHEMBL9294033 0.82 NAAA (0.51) NAAANPSR1RAD52FAAHDGKA
SCHEMBL9293942 0.82 NAAA (0.51) NAAANPSR1RAD52FAAHDGKA
SCHEMBL9294423 0.82 NAAA (0.51) NAAANPSR1RAD52FAAHDGKA
SCHEMBL9295083 0.82 NAAA (0.51) NAAANPSR1RAD52FAAHDGKA

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