SCHEMBL3279622

SCHEMBL3279622

CCCCCCCN/C=C(\C)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.52
ADH1B P00325 2/20 0.52
ADH1C P00326 2/20 0.52
ADH1A P07327 2/20 0.52
ADH7 P40394 2/20 0.52
ADH4 P08319 1/20 0.52
FNTA P49354 2/20 0.44
FNTB P49356 2/20 0.44
THRB P10828 1/20 0.44
PGGT1B P53609 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.43
ZDHHC2 Q9UIJ5 1/20 0.43
CASP2 P42575 1/20 0.41
EP300 Q09472 1/20 0.41
HAO1 Q9UJM8 1/20 0.40
FAAH O00519 1/20 0.40
ALOX15 P16050 1/20 0.39
EPHX2 P34913 3/20 0.39

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
SCHEMBL3285116 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL3284685 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL3285120 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL27828178 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL3284687 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL3279628 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL3278326 0.98 EPHX1 (0.48) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL3278327 0.98 EPHX1 (0.48) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL3076357 0.92 ALOX15 (0.47) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL3076362 0.92 ALOX15 (0.47) EPHX1ADH1BADH1CADH1AADH7

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
US-20070113353-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY 2007-05-24 US claimed
US-20100160487-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY (US) 2010-06-24 US disclosed
US-7699941-B2 Polymeric surface treatment compositions THE CLOROX COMPANY (US) 2010-04-20 US disclosed
US-20070113353-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY 2007-05-24 US disclosed