SCHEMBL20239098

SCHEMBL20239098

C=C(C)C(=O)NCc1cc(O)c(O)c(O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SELL P14151 2/20 0.43
SELP P16109 2/20 0.43
SELE P16581 2/20 0.43
IGF1R P08069 3/20 0.40
KDM4E B2RXH2 3/20 0.40
LMNA P02545 3/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
BLM P54132 2/20 0.40
HPGD P15428 1/20 0.40
PTGS1 P23219 1/20 0.40
HIF1A Q16665 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ERCC1 P07992 3/20 0.39
ERCC4 Q92889 3/20 0.39
POLB P06746 2/20 0.36
GAA P10253 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
NFKB1 P19838 1/20 0.36

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
SCHEMBL20746326 0.84 KDM4E (0.50) SELLSELPSELEKDM4ELMNA
SCHEMBL207449 0.84 MEN1 (0.41) LMNAALDH1A1MAPTPTGS1POLB
SCHEMBL339753 0.83 ERCC1 (0.59) KDM4ELMNAALDH1A1MAPTBLM
SCHEMBL11795666 0.83 TRPV1 (0.43) KDM4ELMNAALDH1A1MAPTBLM
SCHEMBL26674162 0.81 MAOB (0.39) HTT
SCHEMBL11801454 0.80 TRPV1 (0.39) ERCC1ERCC4POLBGAATDP1
SCHEMBL4330346 0.80 GAA (0.51) LMNAALDH1A1MAPTBLMHIF1A
SCHEMBL11800157 0.80 GAA (0.46) LMNAALDH1A1MAPTGAAHTT
SCHEMBL731190 0.79 KMT2A (0.50) ALDH1A1MAPTPOLBL3MBTL1HTT
SCHEMBL11793579 0.78 TRPV1 (0.42) POLB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108294957-B Dental resin adhesive containing unsaturated fatty acid polyphenol amide derivatives 成都交大麦迪克科技有限公司 2020-10-23 CN claimed
CN-108294957-B Dental resin adhesive containing unsaturated fatty acid polyphenol amide derivatives 成都交大麦迪克科技有限公司 2020-10-23 CN disclosed
CN-108294957-B Dental resin adhesive containing unsaturated fatty acid polyphenol amide derivatives 成都交大麦迪克科技有限公司 2020-10-23 CN disclosed
US-20180163078-A1 SYNTHETIC POLYMERIC ANTIOXIDANTS FOR CORROSION PROTECTION THE TEXAS A&M UNIVERSITY SYSTEM 2018-06-14 US disclosed