SCHEMBL4642430

SCHEMBL4642430

CCOC(=O)/C=C/C(=O)OCC(=O)Oc1cccc(O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CYP3A4 P08684 1/20 0.49
ALDH1A1 P00352 3/20 0.46
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
HSD17B1 P14061 1/20 0.44
HSD17B2 P37059 1/20 0.44
LMNA P02545 3/20 0.43
MDM2 Q00987 2/20 0.43
MDM4 O15151 1/20 0.43
THRB P10828 1/20 0.42
TTR P02766 1/20 0.42
DPP4 P27487 1/20 0.42
TYR P14679 1/20 0.42
ESR1 P03372 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
SCHEMBL4641671 1.00 MAPT (0.49) MAPTL3MBTL1CYP3A4ALDH1A1CA12
SCHEMBL4641661 1.00 MAPT (0.49) MAPTL3MBTL1CYP3A4ALDH1A1CA12
SCHEMBL4642073 0.89 CYP3A4 (0.49) MAPTL3MBTL1CYP3A4ALDH1A1TYR
SCHEMBL4642081 0.89 CYP3A4 (0.49) MAPTL3MBTL1CYP3A4ALDH1A1TYR
SCHEMBL4645024 0.89 CYP3A4 (0.49) MAPTL3MBTL1CYP3A4ALDH1A1TYR
SCHEMBL4647847 0.85 CYP3A4 (0.44) MAPTL3MBTL1CYP3A4ALDH1A1CA12
SCHEMBL4648023 0.85 CYP3A4 (0.44) MAPTL3MBTL1CYP3A4ALDH1A1CA12
SCHEMBL4642198 0.83 CA12 (0.56) MAPTL3MBTL1ALDH1A1CA12CA1
SCHEMBL4641366 0.83 CA12 (0.56) MAPTL3MBTL1ALDH1A1CA12CA1
SCHEMBL4641363 0.83 CA12 (0.56) MAPTL3MBTL1ALDH1A1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP 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