SCHEMBL3285121

SCHEMBL3285121

CCCCCN/C(C)=C(\C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.54
CASP2 P42575 1/20 0.48
THRB P10828 1/20 0.47
FNTA P49354 1/20 0.47
FNTB P49356 1/20 0.47
PGGT1B P53609 1/20 0.47
FAAH O00519 1/20 0.46
NAAA Q02083 2/20 0.46
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
PLA2G2A P14555 1/20 0.44
PAOX Q6QHF9 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
PRCP P42785 1/20 0.43
DPP7 Q9UHL4 1/20 0.43

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
SCHEMBL3277705 0.98 EPHX1 (0.57) EPHX1CASP2THRBFNTAFNTB
SCHEMBL3284591 0.98 EPHX1 (0.57) EPHX1CASP2THRBFNTAFNTB
SCHEMBL17845063 0.98 EPHX1 (0.57) EPHX1CASP2THRBFNTAFNTB
SCHEMBL3285612 0.98 EPHX1 (0.57) EPHX1CASP2THRBFNTAFNTB
SCHEMBL17845061 0.98 EPHX1 (0.57) EPHX1CASP2THRBFNTAFNTB
SCHEMBL3279679 0.85 MMP1 (0.41) EPHX1THRBFNTAFNTBPGGT1B
SCHEMBL30229366 0.80 EPHX1 (0.55) EPHX1CASP2THRBFNTAFNTB
SCHEMBL1275796 0.79 EPHX1 (0.53) EPHX1CASP2THRBFNTAFNTB
SCHEMBL1275792 0.79 EPHX1 (0.53) EPHX1CASP2THRBFNTAFNTB
SCHEMBL6064920 0.79 EPHX1 (0.53) EPHX1CASP2THRBFNTAFNTB

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