SCHEMBL4643873

SCHEMBL4643873

COC(=O)/C=C/C(=O)OC(C)(C)C(C)C(=O)OC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GFPT1 Q06210 1/20 0.30

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
SCHEMBL4646193 1.00 HCAR2 (0.42) HCAR2KEAP1NFE2L2ALDH1A1TSHR
SCHEMBL4645546 0.84 HCAR2 (0.43) HCAR2ALDH1A1TSHRMAPT
SCHEMBL4641548 0.84 HCAR2 (0.43) HCAR2ALDH1A1TSHRMAPT
SCHEMBL4642308 0.82 HCAR2 (0.43) HCAR2KEAP1NFE2L2GFPT1
SCHEMBL4647921 0.82 HCAR2 (0.43) HCAR2KEAP1NFE2L2GFPT1
SCHEMBL4643716 0.72 HCAR2 (0.43) HCAR2KEAP1NFE2L2ALDH1A1TSHR
SCHEMBL4642281 0.72 HCAR2 (0.43) HCAR2KEAP1NFE2L2ALDH1A1TSHR
SCHEMBL11747549 0.70 HCAR2 (0.39) HCAR2KEAP1NFE2L2
SCHEMBL4583811 0.70 HCAR2 (0.39) HCAR2KEAP1NFE2L2
SCHEMBL11746578 0.70 HCAR2 (0.39) HCAR2KEAP1NFE2L2

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