SCHEMBL4407017

SCHEMBL4407017

O=C(O)CC(O)CC[S+]([O-])c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 10/20 0.47
MMP13 P45452 9/20 0.47
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
MMP14 P50281 1/20 0.47
SLC22A6 Q4U2R8 1/20 0.39
GPR84 Q9NQS5 4/20 0.36
CYP2C19 P33261 1/20 0.36
CPA1 P15085 2/20 0.35
GABBR2 O75899 1/20 0.35
GABBR1 Q9UBS5 1/20 0.35
CPB1 P15086 1/20 0.35
CPA3 P15088 1/20 0.35
CPB2 Q96IY4 1/20 0.35

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
SCHEMBL5682089 0.86 MMP12 (0.38) MMP12MMP13MMP2MMP9MMP14
SCHEMBL5683071 0.86 MMP12 (0.38) MMP12MMP13MMP2MMP9MMP14
SCHEMBL5682990 0.84 MMP12 (0.44) MMP12MMP13MMP2MMP9MMP14
SCHEMBL5718698 0.84 MMP12 (0.38) MMP12MMP13MMP2MMP9MMP14
SCHEMBL29131357 0.79 CYP1A2 (0.35) CYP2C19CPA1CPA3
SCHEMBL6360896 0.78 MMP12 (0.40) MMP12MMP13MMP2MMP9MMP14
SCHEMBL9322167 0.74 KEAP1 (0.43) CYP2C19CPA3
SCHEMBL7610535 0.74 CPA3 (0.53) CYP2C19CPA3
SCHEMBL27852451 0.74 CYP2C19 (0.39) MMP12MMP13MMP2MMP9MMP14
SCHEMBL7359806 0.71 CYP2C19 (0.40) CYP2C19CPA1GABBR2GABBR1CPB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090029423-A1 METHOD FOR SEPARATING TARGET COMPONENT CANON KABUSHIKI KAISHA (JP) 2009-01-29 US disclosed
US-7452960-B2 Polyhydroxyalkanoate copolymer, resin composition, molded product, toner, image forming method and image forming apparatus CANON KABUSHIKI KAISHA (JP) 2008-11-18 US disclosed
US-20070027291-A1 Structure and method for producing structure, toner containing structure, image forming method and device using toner CANON KABUSHIKI KAISHA (JP) 2007-02-01 US disclosed
US-20070003975-A1 Structured construct and producing method therefor CANON KABUSHIKI KAISHA (JP) 2007-01-04 US disclosed
EP-1253162-B1 Polyhydroxyalkanoates having in its side chain phenylsulfinyl structure and/or phenyl sulfonyl structure and production process therefore; charge control agent, toner binder and toner containing same; image forming method and image forming apparatus using the toner CANON KK (JP) 2006-04-19 EP disclosed
EP-1253161-B1 Polyhydroxyalkanoate, its production method, charge control agent containing the polyhydroxyalkanoate, toner binder and toner, and image forming method and image forming apparatus using the toner CANON KK (JP) 2006-03-22 EP disclosed
US-20060040196-A1 New polyhydroxyalkanoate copolymer, resin composition, molded product, toner, image forming method and image forming apparatus CANON KABUSHIKI KAISHA (JP) 2006-02-23 US disclosed
US-6908720-B2 Polyhydroxyalkanoate, its production method, charge control agent containing the polyhydroxyalkanoate, toner binder and toner, and image forming method and image forming apparatus using the toner CANON KABUSHIKI KAISHA (JP) 2005-06-21 US disclosed
WO-2004097417-A1 STRUCTURED CONSTRUCT AND PRODUCING METHOD THEREFOR CANON KABUSHIKI KAISHA (JP) 2004-11-11 WO disclosed
US-6808854-B2 PRODUCED BY OXIDIZING WITH A PEROXIDE A BIOSYNTHETIC POLYHYDROXYALKANOATE; BIODEGRADABLE CANON KABUSHIKI KAISHA (JP) 2004-10-26 US disclosed
WO-2004041905-A1 NEW POLYHYDROXYALKANOATE COPOLYMER, RESIN COMPOSITION, MOLDED PRODUCT, TONER, IMAGE FORMING METHOD AND IMAGE FORMING APPARATUS CANON KABUSHIKI KAISHA (JP) 2004-05-21 WO disclosed
US-20030104300-A1 Novel polyhydroxyalkanoate, its production method, charge control agent containing the polyhydroxyalkanoate, toner binder and toner, and image forming method and image forming apparatus using the toner CANON KABUSHIKI KAISHA (JP) 2003-06-05 US disclosed
US-20030100700-A1 Novel polyhydroxyalkanoates having in its side chain phenylsulfinyl structure and/or phenyl sulfonyl structure and production process therefor; charge control agent, toner binder and toner containing same; and image forming method and image forming apparatus using the toner CANON KABUSHIKI KAISHA (JP) 2003-05-29 US disclosed
EP-1253162-A2 Polyhydroxyalkanoates having in its side chain phenylsulfinyl structure and/or phenyl sulfonyl structure and production process therefore; charge control agent, toner binder and toner containing same; image forming method and image forming apparatus using the toner CANON KABUSHIKI KAISHA (JP) 2002-10-30 EP disclosed
EP-1253161-A2 Polyhydroxyalkanoate, its production method, charge control agent containing the polyhydroxylalkanoate, toner binder and toner, and image forming method and image forming apparatus using the toner CANON KABUSHIKI KAISHA (JP) 2002-10-30 EP disclosed