SCHEMBL6046312

SCHEMBL6046312

N#C/C(=C\c1cc(O)c(O)c(O)c1)C(=O)O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.72
MEN1 O00255 2/20 0.72
MAPT P10636 2/20 0.72
BLM P54132 2/20 0.72
KMT2A Q03164 2/20 0.72
TDP1 Q9NUW8 2/20 0.72
POLB P06746 1/20 0.72
GAA P10253 1/20 0.72
APEX1 P27695 1/20 0.72
EGFR P00533 6/20 0.70
DNM1 Q05193 5/20 0.64
ALDH1A1 P00352 2/20 0.61
CYP3A4 P08684 2/20 0.61
HPGD P15428 2/20 0.61
CISD1 Q9NZ45 1/20 0.61
SLC16A3 O15427 1/20 0.61
SLC16A1 P53985 1/20 0.61
GPR35 Q9HC97 1/20 0.61
RGS12 O14924 1/20 0.58
USP2 O75604 1/20 0.58

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
SCHEMBL6046314 1.00 KDM4E (0.72) KDM4EMEN1MAPTBLMKMT2A
SCHEMBL7820539 0.86 DNM1 (0.70) KDM4EMEN1MAPTBLMKMT2A
SCHEMBL7820542 0.86 DNM1 (0.70) KDM4EMEN1MAPTBLMKMT2A
SCHEMBL8848272 0.83 FTO (0.74) MEN1MAPTKMT2AEGFRALDH1A1
SCHEMBL8848276 0.83 FTO (0.74) MEN1MAPTKMT2AEGFRALDH1A1
SCHEMBL8848281 0.83 FTO (0.74) MEN1MAPTKMT2AEGFRALDH1A1
SCHEMBL20100865 0.83 FTO (0.74) MEN1MAPTKMT2AEGFRALDH1A1
SCHEMBL6286665 0.82 EGFR (1.00) KDM4EMEN1MAPTBLMKMT2A
SCHEMBL5908882 0.82 EGFR (1.00) KDM4EMEN1MAPTBLMKMT2A
SCHEMBL17457139 0.82 EGFR (1.00) KDM4EMEN1MAPTBLMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060261267-A1 Composite MALDI matrix material and methods of using it and kits thereof in MALDI AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH 2006-11-23 US claimed
WO-2006124003-A1 COMPOSITE MALDI MATRIX MATERIAL AND METHODS OF USING IT AND KITS THEREOF IN MALDI AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2006-11-23 WO claimed
EP-0339671-B1 Derivative of caffeic acid and pharmaceutical composition containing the same SUNTORY LTD (JP) 1994-08-10 EP disclosed
US-5063243-A Arteriosclerosis treatment SUNTORY, LTD. (JP) 1991-11-05 US disclosed
EP-0339671-A2 Derivative of caffeic acid and pharmaceutical composition containing the same SUNTORY LIMITED (JP) 1989-11-02 EP disclosed