SCHEMBL4644456

SCHEMBL4644456

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.51
CA1 P00915 3/20 0.51
CA2 P00918 3/20 0.51
CA7 P43166 3/20 0.51
CA9 Q16790 3/20 0.51
CA14 Q9ULX7 3/20 0.51
MAPT P10636 5/20 0.50
ALDH1A1 P00352 4/20 0.50
CYP4F2 P78329 1/20 0.49
CYP4A11 Q02928 1/20 0.49
PDCD1 Q15116 1/20 0.47
CD274 Q9NZQ7 1/20 0.47
KMT2A Q03164 5/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 2/20 0.45
HSD17B10 Q99714 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL4644334 0.91 CA12 (0.49) CA12CA1CA2CA7CA9
SCHEMBL4644650 0.90 CA12 (0.47) CA12CA1CA2CA7CA9
SCHEMBL4644300 0.88 CA12 (0.54) CA12CA1CA2CA7CA9
SCHEMBL4645749 0.86 CYP4F2 (0.58) CA12CA1CA2CA7CA9
SCHEMBL4647496 0.85 CA12 (0.51) CA12CA1CA2CA7CA9
SCHEMBL27619968 0.84 CA12 (0.47) CA12CA1CA2CA7CA9
SCHEMBL4646071 0.84 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL4645898 0.84 CYP4A11 (0.55) CA12CA1CA2CA7CA9
SCHEMBL4644493 0.83 CYP4F2 (0.57) CA12CA1CA2CA7CA9
SCHEMBL4644607 0.83 MAPT (0.58) CA12CA1CA2CA7CA9

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