SCHEMBL4645898

SCHEMBL4645898

CC(C)OC(=O)c1ccc(OC(=O)CCCO)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4A11 Q02928 2/20 0.55
CYP4F2 P78329 1/20 0.55
CA12 O43570 3/20 0.50
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA7 P43166 3/20 0.50
CA9 Q16790 3/20 0.50
CA14 Q9ULX7 3/20 0.50
ALDH1A1 P00352 3/20 0.49
MAPT P10636 3/20 0.49
PDCD1 Q15116 1/20 0.46
CD274 Q9NZQ7 1/20 0.46
KMT2A Q03164 6/20 0.44
MEN1 O00255 2/20 0.44
SLC22A2 O15244 1/20 0.44
TMPRSS2 O15393 1/20 0.44
F2 P00734 1/20 0.44
F10 P00742 1/20 0.44
PLG P00747 1/20 0.44
F12 P00748 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
SCHEMBL4641668 0.96 CYP4F2 (0.54) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL4645749 0.91 CYP4F2 (0.58) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL4646071 0.88 CA12 (0.50) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL4644334 0.87 CA12 (0.49) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL4644650 0.86 CA12 (0.47) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL27619968 0.86 CA12 (0.47) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL4644493 0.84 CYP4F2 (0.57) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL4647496 0.84 CA12 (0.51) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL4644456 0.84 CA12 (0.51) CYP4A11CYP4F2CA12CA1CA2
SCHEMBL4646126 0.83 CYP4A11 (0.57) CYP4A11CYP4F2CA1CA2ALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100519671-C Film-forming polymer and antifouling paint JOTUN AS (NO) 2009-07-29 CN disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed