SCHEMBL4647771

SCHEMBL4647771

COC(=O)/C=C\C(=O)OC(C(=O)OC(C)=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.47
ALDH1A1 P00352 5/20 0.44
CYP3A4 P08684 1/20 0.44
KMT2A Q03164 1/20 0.42
TSHR P16473 1/20 0.42
MAPT P10636 4/20 0.39
LMNA P02545 2/20 0.39
MDM4 O15151 1/20 0.39
MDM2 Q00987 1/20 0.39
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
KLK7 P49862 1/20 0.39
HTT P42858 1/20 0.38
GLS O94925 2/20 0.38
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
TDP1 Q9NUW8 2/20 0.37
GAA P10253 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
SCHEMBL4645072 1.00 HCAR2 (0.47) HCAR2ALDH1A1CYP3A4KMT2ATSHR
SCHEMBL4642383 0.86 KLK7 (0.40) ALDH1A1KMT2AMAPTLMNAKLK7
SCHEMBL4647206 0.86 MAPT (0.52) HCAR2ALDH1A1CYP3A4TSHRMAPT
SCHEMBL4646915 0.86 KLK7 (0.40) ALDH1A1KMT2AMAPTLMNAKLK7
SCHEMBL4645338 0.86 MAPT (0.52) HCAR2ALDH1A1CYP3A4TSHRMAPT
SCHEMBL6553835 0.80 HCAR2 (0.47) HCAR2ALDH1A1KMT2AMAPTLMNA
SCHEMBL27265474 0.78 ALDH1A1 (0.50) ALDH1A1CYP3A4KMT2ALMNAKDM4E
SCHEMBL4645080 0.78 ALDH1A1 (0.42) HCAR2ALDH1A1CYP3A4KMT2ATSHR
SCHEMBL4643250 0.76 ALDH1A1 (0.40) HCAR2ALDH1A1CYP3A4KMT2ATSHR
SCHEMBL4644962 0.75 TDP1 (0.40) HCAR2ALDH1A1CYP3A4KMT2AMAPT

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