SCHEMBL4644127

SCHEMBL4644127

COC(=O)C=CC(=O)OC(C(=O)OC(C)=O)C(C)(C(=O)c1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.38
PARP1 P09874 1/20 0.36
PARP15 Q460N3 1/20 0.36
PARP14 Q460N5 1/20 0.36
PARP10 Q53GL7 1/20 0.36
HCAR2 Q8TDS4 3/20 0.35
CES1 P23141 1/20 0.35
ALDH1A1 P00352 3/20 0.34
MAPT P10636 2/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 2/20 0.33
TSHR P16473 1/20 0.33
CYP3A4 P08684 1/20 0.33
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
GAA P10253 1/20 0.32
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
PRSS1 P07477 2/20 0.32

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
SCHEMBL4643564 0.88 MAPT (0.43) HCAR2ALDH1A1MAPTKMT2A
SCHEMBL4645080 0.77 ALDH1A1 (0.42) PARP1PARP15PARP14PARP10HCAR2
SCHEMBL4643716 0.77 HCAR2 (0.43) HCAR2ALDH1A1MAPTTSHRKEAP1
SCHEMBL4642281 0.77 HCAR2 (0.43) HCAR2ALDH1A1MAPTTSHRKEAP1
SCHEMBL4643250 0.75 ALDH1A1 (0.40) PARP1PARP15PARP14PARP10HCAR2
SCHEMBL4647771 0.74 HCAR2 (0.47) HCAR2ALDH1A1MAPTHTTKMT2A
SCHEMBL4645072 0.74 HCAR2 (0.47) HCAR2ALDH1A1MAPTHTTKMT2A
SCHEMBL4645122 0.73 SRC (0.43) SRCPARP1PARP15PARP14PARP10
SCHEMBL4644585 0.68 SRC (0.40) SRCPARP1PARP15PARP14PARP10
SCHEMBL4641582 0.67 SRC (0.39) SRCPARP1PARP15PARP14PARP10

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