SCHEMBL5075684

SCHEMBL5075684

O=S(=O)(O)OCCc1ccccc1CCO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
TDP1 Q9NUW8 1/20 0.34
CYP4F2 P78329 2/20 0.33
CYP4A11 Q02928 2/20 0.33
PTPN1 P18031 2/20 0.33
CA12 O43570 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
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
ALDH1A1 P00352 2/20 0.31
RECQL P46063 1/20 0.31
FFAR1 O14842 1/20 0.31
TYR P14679 1/20 0.31
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL2061401 0.84 KDM4E (0.39) CA1CA2CA9TDP1CYP4F2
SCHEMBL5079821 0.82 CA2 (0.36) CA1CA2CA9CYP4F2CYP4A11
Ethylene Glycol SCHEMBL4591884 0.80 NQO2 (0.47) CA1CA2CA9TDP1CA12
SCHEMBL28854623 0.80 CA1 (0.41) CA1CA2CA9TDP1CA12
SCHEMBL31035381 0.80 TAAR1 (0.46) ALDH1A1
SCHEMBL4742721 0.76 ALDH1A1 (0.50) CA1CA2CA12ALDH1A1RECQL
SCHEMBL3373578 0.75 CA1 (0.66) CA1CA2CA9TDP1CA12
SCHEMBL31203 0.74 TDP1 (0.55) CA2TDP1CYP4F2CYP4A11PTPN1
SCHEMBL29534868 0.74 TDP1 (0.55) CA2TDP1CYP4F2CYP4A11PTPN1
Phosphine SCHEMBL29064577 0.73 CA1 (0.63) CA1CA2CA9TDP1CA12

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