SCHEMBL737533

SCHEMBL737533

O=c1c(Oc2cccc3ccccc23)c(Oc2cccc3ccccc23)c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
KDM4E B2RXH2 4/20 0.46
HPGD P15428 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
GAA P10253 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
MAPT P10636 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD17B10 Q99714 3/20 0.44
PGR P06401 1/20 0.44
PTGS1 P23219 1/20 0.44
MAPK1 P28482 1/20 0.44
HTR1B P28222 4/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
RAB9A P51151 1/20 0.43
ESRRA P11474 1/20 0.43
SIRT2 Q8IXJ6 1/20 0.42
SIRT1 Q96EB6 1/20 0.42
SIRT3 Q9NTG7 1/20 0.42

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
SCHEMBL5402131 0.85 HTR1B (0.48) ALDH1A1KDM4EHPGDTDP1GAA
SCHEMBL29577853 0.82 HTR1B (0.54) ALDH1A1KDM4EHPGDTDP1GAA
SCHEMBL442767 0.82 HTR1B (0.54) ALDH1A1KDM4EHPGDTDP1GAA
Formaldehyde SCHEMBL28332208 0.80 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDTDP1GAA
SCHEMBL27559989 0.80 HTR1B (0.52) ALDH1A1KDM4EHPGDTDP1GAA
SCHEMBL27339322 0.80 HTR1B (0.52) ALDH1A1KDM4EHPGDTDP1GAA
Phosphine SCHEMBL28264511 0.80 HTR1B (0.52) ALDH1A1KDM4EHPGDTDP1GAA
Lithium SCHEMBL6571336 0.80 HTR1B (0.52) ALDH1A1KDM4EHPGDTDP1GAA
Methane SCHEMBL10959030 0.80 HTR1B (0.52) ALDH1A1KDM4EHPGDTDP1GAA
SCHEMBL7457103 0.80 HTR1B (0.52) ALDH1A1KDM4EHPGDTDP1GAA

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-8138231-B2 Polymer having oxycarbon group, and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-20 US disclosed
US-20090233142-A2 POLYMER HAVING OXOCARBON GROUP, AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-09-17 US disclosed
US-20090110995-A1 POLYMER HAVING OXYCARBON GROUP, AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-30 US disclosed
US-20070218335-A1 POLYMER HAVING OXOCARBON GROUP, AND USE THEREOF KAO CORPORATION (JP) 2007-09-20 US disclosed
EP-1741740-A1 POLYMER HAVING OXOCARBON GROUP AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2007-01-10 EP disclosed