SCHEMBL4642137

SCHEMBL4642137

CCC(OC(=O)/C=C\C(=O)OC)C(=O)Oc1ccc(OC)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 3/20 0.43
TAS1R1 Q7RTX1 3/20 0.43
KLK7 P49862 5/20 0.43
TDP1 Q9NUW8 2/20 0.43
GSK3B P49841 1/20 0.41
PKM P14618 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.39
FAAH O00519 1/20 0.39
MAOB P27338 1/20 0.38

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
SCHEMBL4642151 1.00 TAS1R3 (0.43) TAS1R3TAS1R1KLK7TDP1GSK3B
SCHEMBL4644928 1.00 TAS1R3 (0.43) TAS1R3TAS1R1KLK7TDP1GSK3B
SCHEMBL4643299 0.90 TDP1 (0.44) TAS1R3TAS1R1KLK7TDP1ALDH1A1
SCHEMBL4643900 0.90 TDP1 (0.44) TAS1R3TAS1R1KLK7TDP1ALDH1A1
SCHEMBL4643307 0.90 TDP1 (0.44) TAS1R3TAS1R1KLK7TDP1ALDH1A1
SCHEMBL4644857 0.90 CA12 (0.44) ALDH1A1KMT2ALMNAMAOB
SCHEMBL4641952 0.90 CA12 (0.44) ALDH1A1KMT2ALMNAMAOB
SCHEMBL4641963 0.90 CA12 (0.44) ALDH1A1KMT2ALMNAMAOB
SCHEMBL4644149 0.89 MMP1 (0.39) TDP1ALDH1A1KMT2ALMNAMAOB
SCHEMBL4646386 0.89 MMP1 (0.39) TDP1ALDH1A1KMT2ALMNAMAOB

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