SCHEMBL6263286

SCHEMBL6263286

CCCCCCCCCCCCCCCC(=S)NCC(C)O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 1/20 0.44
MAPT P10636 1/20 0.41
FAAH O00519 2/20 0.40
MEN1 O00255 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
EPHX1 P07099 1/20 0.37
ASAH1 Q13510 1/20 0.36

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
SCHEMBL20883267 0.86 EPHX1 (0.50) SOAT1FAAHMEN1MAPK1KMT2A
SCHEMBL5407496 0.86 SOAT1 (0.41) SOAT1FAAHMEN1MAPK1KMT2A
SCHEMBL5404438 0.81 MEN1 (0.44) SOAT1MAPTFAAHMEN1MAPK1
SCHEMBL6266161 0.79 SOAT1 (0.40) SOAT1MAPTFAAHMEN1MAPK1
SCHEMBL6269044 0.79 SOAT1 (0.40) SOAT1FAAHMEN1MAPK1KMT2A
SCHEMBL10502654 0.78 SOAT1 (0.39) SOAT1FAAHMEN1MAPK1KMT2A
SCHEMBL23521368 0.77 FAAH (0.62) MAPTFAAHMEN1MAPK1KMT2A
SCHEMBL679248 0.77 FAAH (0.62) MAPTFAAHMEN1MAPK1KMT2A
SCHEMBL8341797 0.77 FAAH (0.62) MAPTFAAHMEN1MAPK1KMT2A
SCHEMBL11513011 0.77 FAAH (0.62) MAPTFAAHMEN1MAPK1KMT2A

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-1592660-A1 ACYLATED AMINOPROPANEDIOLS AND ANALOGUES AND THERAPEUTIC USES THEREOF Genfit (FR) 2005-11-09 EP claimed
WO-2004074239-A1 ACYLATED AMINOPROPANEDIOLS AND ANALOGUES AND THERAPEUTIC USES THEREOF GENFIT (FR) 2004-09-02 WO claimed
EP-1596845-A1 THERAPEUTIC USE OF ACYL GLYCEROLS AND THE NITROGEN- AND SULPHUR-CONTAINING ANALOGUES THEROF Genfit (FR) 2005-11-23 EP disclosed
WO-2004073698-A1 THERAPEUTIC USE OF ACYL GLYCEROLS AND THE NITROGEN- AND SULPHUR-CONTAINING ANALOGUES THEROF GENFIT (FR) 2004-09-02 WO disclosed