SCHEMBL4642242

SCHEMBL4642242

CCOC(=O)/C=C/C(=O)OCCCC(=O)Oc1cc(O)cc(O)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.42
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
CA14 Q9ULX7 2/20 0.41
HCAR2 Q8TDS4 4/20 0.39
TTR P02766 1/20 0.39
DPP4 P27487 1/20 0.39
APP P05067 4/20 0.39
MAPT P10636 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
EPHX2 P34913 1/20 0.38
BRD4 O60885 1/20 0.38
LMNA P02545 1/20 0.37
MDM2 Q00987 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL4642939 1.00 ATM (0.42) ATMCA12CA1CA2CA7
SCHEMBL4643897 0.89 MAPT (0.41) ATMCA12CA1CA2CA7
SCHEMBL4644748 0.89 MAPT (0.41) ATMCA12CA1CA2CA7
SCHEMBL4647847 0.87 CYP3A4 (0.44) CA12CA1CA2CA7CA9
SCHEMBL4648023 0.87 CYP3A4 (0.44) CA12CA1CA2CA7CA9
SCHEMBL4644368 0.86 CA12 (0.51) ATMCA12CA1CA2CA7
SCHEMBL4644875 0.86 CA12 (0.51) ATMCA12CA1CA2CA7
SCHEMBL4644379 0.86 CA12 (0.51) ATMCA12CA1CA2CA7
SCHEMBL4644504 0.83 CA12 (0.50) ATMCA12CA1CA2CA7
SCHEMBL4643321 0.83 CA12 (0.50) ATMCA12CA1CA2CA7

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