SCHEMBL4647600

SCHEMBL4647600

CCOC(=O)/C=C\C(=O)OCCC(=O)OC(=O)CCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.55
TDP1 Q9NUW8 1/20 0.54
MAPT P10636 4/20 0.50
AKR1B10 O60218 4/20 0.49
AKR1B1 P15121 4/20 0.49
CYP4F2 P78329 1/20 0.46
CYP4A11 Q02928 1/20 0.46
MAOB P27338 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ABCB1 P08183 1/20 0.44
LMNA P02545 2/20 0.43
MDM2 Q00987 2/20 0.43
MDM4 O15151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALOX5 P09917 1/20 0.43
TTR P02766 1/20 0.43

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
SCHEMBL4643588 1.00 HCAR2 (0.55) HCAR2TDP1MAPTAKR1B10AKR1B1
SCHEMBL4643598 1.00 HCAR2 (0.55) HCAR2TDP1MAPTAKR1B10AKR1B1
SCHEMBL4645348 0.89 MAPT (0.50) HCAR2TDP1MAPTAKR1B10AKR1B1
SCHEMBL4647030 0.89 MAPT (0.56) HCAR2TDP1MAPTCYP4F2CYP4A11
SCHEMBL4643868 0.89 MAPT (0.50) HCAR2TDP1MAPTAKR1B10AKR1B1
SCHEMBL4643876 0.89 MAPT (0.50) HCAR2TDP1MAPTAKR1B10AKR1B1
SCHEMBL4644575 0.89 MAPT (0.56) HCAR2TDP1MAPTCYP4F2CYP4A11
SCHEMBL4644567 0.89 MAPT (0.56) HCAR2TDP1MAPTCYP4F2CYP4A11
SCHEMBL27735855 0.84 HCAR2 (0.76) HCAR2TDP1MAPTAKR1B10AKR1B1
SCHEMBL4647594 0.82 MAPT (0.46) HCAR2TDP1MAPTCYP4F2CYP4A11

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