SCHEMBL5075686

SCHEMBL5075686

O=S(=O)(O)c1cccc(CCO)c1CCO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.38
CYP1A2 P05177 2/20 0.33
MYC P01106 1/20 0.33
FABP4 P15090 1/20 0.32
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
MAPK14 Q16539 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
ALDH1A1 P00352 1/20 0.31
NR4A1 P22736 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL5073911 0.91 TTR (0.37) TTRCYP1A2MYCFABP4CCNA2
SCHEMBL5079828 0.86 CA2 (0.36) TTRCYP1A2MYCFABP4CCNA2
SCHEMBL10937088 0.85 BID (0.40) CYP1A2TDP1TSHR
SCHEMBL31344732 0.84 CA2 (0.42) CDK2CA12CA1CA2CA4
SCHEMBL1807545 0.82 MYC (0.43) TTRCYP1A2MYCFABP4CCNA2
SCHEMBL10865912 0.81 MYC (0.42) TTRCYP1A2MYCFABP4CCNA2
SCHEMBL1807475 0.80 MYC (0.39) TTRCYP1A2MYCFABP4CCNA2
SCHEMBL29085257 0.80 TTR (0.44) TTRCYP1A2MYCFABP4CCNA2
SCHEMBL1806784 0.80 MYC (0.39) TTRCYP1A2MYCCA12CA1
SCHEMBL152074 0.80 TTR (0.37) TTRCYP1A2MYCCA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7408000-B2 Dispersant or coatability improver SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2008-08-05 US disclosed
US-7112625-B2 Thermocrosslinkable resin dispersion SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2006-09-26 US disclosed
US-20050250907-A1 Dispersant or coatability improver SANYO CHEMICAL INDUSTRIES LTD., (JP) 2005-11-10 US disclosed
EP-1579907-A2 Dispersant or coatability improver SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2005-09-28 EP disclosed
US-20050203242-A1 good film-forming properties even at low temperatures; excellent in gasohol resistance (gasoline resistance and alcohol resistance) and water resistance SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2005-09-15 US disclosed
EP-1500681-A1 THERMOCROSSLINKABLE RESIN DISPERSION SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2005-01-26 EP disclosed