SCHEMBL4641322

SCHEMBL4641322

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

nearest known ligand 0.42

Predicted protein targets (top 8)

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

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
SCHEMBL4644072 0.84 HCAR2 (0.42) HCAR2KEAP1NFE2L2ALDH1A1TSHR
SCHEMBL4641536 0.83 HCAR2 (0.42) HCAR2ALDH1A1MAPT
SCHEMBL4641685 0.77 HCAR2 (0.35) HCAR2KEAP1NFE2L2
SCHEMBL4642714 0.77 HCAR2 (0.35) HCAR2KEAP1NFE2L2
SCHEMBL4645122 0.76 SRC (0.43) HCAR2KEAP1NFE2L2ALDH1A1TSHR
SCHEMBL4646092 0.74 MAPT (0.39) ALDH1A1KDM4EMAPTTDP1
SCHEMBL6553847 0.72 ABCG2 (0.39) KDM4EMAPT
SCHEMBL4643974 0.70 HCAR2 (0.41) HCAR2KEAP1NFE2L2ALDH1A1TSHR
SCHEMBL8449337 0.68 NFE2L2 (0.65) HCAR2KEAP1NFE2L2ALDH1A1KDM4E
SCHEMBL8451389 0.68 NFE2L2 (0.65) HCAR2KEAP1NFE2L2ALDH1A1KDM4E

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