SCHEMBL3200512

SCHEMBL3200512

O=C(O)CC(O)CCSc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
MMP12 P39900 5/20 0.50
MMP13 P45452 4/20 0.50
MMP2 P08253 2/20 0.50
MMP9 P14780 1/20 0.50
MMP14 P50281 1/20 0.50
FFAR1 O14842 1/20 0.50
MAPK1 P28482 1/20 0.48
MTNR1A P48039 2/20 0.45
MTNR1B P49286 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
RECQL P46063 1/20 0.44
HDAC1 Q13547 2/20 0.41
HDAC3 O15379 1/20 0.41

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
SCHEMBL4258900 1.00 ALDH1A1 (0.53) ALDH1A1MMP12MMP13MMP2MMP9
SCHEMBL3947072 0.88 ALDH1A1 (0.57) ALDH1A1MMP12MMP13MMP2MMP9
SCHEMBL4994953 0.85 ALDH1A1 (0.44) ALDH1A1MMP12MMP13MMP2MMP9
SCHEMBL4989028 0.85 MMP12 (0.48) ALDH1A1MMP12MMP13MAPK1CYP1A2
SCHEMBL5718705 0.83 PTGER1 (0.46) ALDH1A1MMP12MMP13MMP2MMP9
SCHEMBL4996628 0.81 FFAR1 (0.53) ALDH1A1MMP12MMP13MMP2MMP9
SCHEMBL5694458 0.81 MMP12 (0.58) MMP12MMP13MMP2MMP9MMP14
SCHEMBL5000556 0.81 MMP12 (0.42) ALDH1A1MMP12MMP13MMP2MMP9
SCHEMBL5694456 0.80 ALDH1A1 (0.46) ALDH1A1MMP12MMP13MAPK1CYP2C19
SCHEMBL4266010 0.79 ALDH1A1 (0.48) ALDH1A1MMP2FFAR1MAPK1MTNR1A

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 83 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7408017-B2 Polyhydroxyalkanoate containing unit with phenylsulfanyl structure in the side chain, process for its production, charge control agent, toner binder and toner which contain novel polyhydroxyalkanoate, and image forming method and image-forming apparatus which make use of the toner CANON KABUSHIKI KAISHA (JP) 2008-08-05 US claimed
US-7045321-B2 POLYHYDROXYALKANOATE CONTAINING UNIT WITH PHENYLSULFANYL STRUCTURE IN THE SIDE CHAIN, PROCESS FOR ITS PRODUCTION, CHARGE CONTROL AGENT, TONER BINDER AND TONER WHICH CONTAIN NOVEL POLYHYDROXYALKANOATE, AND IMAGE-FORMING METHOD AND IMAGE-FORMING APPARATUS WHICH MAKE USE OF THE TONER CANON KABUSHIKI KAISHA (JP) 2006-05-16 US claimed
US-20050250191-A1 Novel polyhydroxyalkanoate containing unit with phenylsulfanyl structure in the side chain, process for its production, charge control agent, toner binder and toner which contain novel polyhydroxyalkanoate, and image forming method and image-forming apparatus which make use of the toner CANON KABUSHIKI KAISHA (JP) 2005-11-10 US claimed
US-20030013841-A1 Novel polyhydroxyalkanoate containing unit with phenylsulfanyl structure in the side chain, process for its production, charge control agent, toner binder and toner which contain novel polyhydroxyalkanoate, and image-forming method and image-forming apparatus which make use of the toner CANON KABUSHIKI KAISHA (JP) 2003-01-16 US claimed
EP-1236755-A2 Novel polyhydroxyalkanoate containing unit phenylsulfanyl structure in the side cahin, process for its production, charge control agent, toner binder and toner which contain novel polyhydroxyalkanoate, and imageforming apparatus which make use of the toner CANON KABUSHIKI KAISHA (JP) 2002-09-04 EP claimed
US-7682765-B2 Toner for developing electrostatic images CANON KABUSHIKI KAISHA (JP) 2010-03-23 US disclosed
US-7638590-B2 Polyhydroxyalkanoate having amide, sulfonic acid or sulfonate ester group, charge control agent and toner CANON KABUSHIKI KAISHA (JP) 2009-12-29 US disclosed
US-7615233-B2 Particulate construct comprising polyhydroxyalkanoate and method for producing it CANON KABUSHIKI KAISHA (JP) 2009-11-10 US disclosed
US-7527809-B2 Polyhydroxyalkanoate-containing magnetic structure, and manufacturing method and use thereof CANON KABUSHIKI KAISHA (JP) 2009-05-05 US disclosed
EP-1275378-B1 Particulate construct comprising polyhydroxyalkanoate and method for producing it CANON KK (JP) 2009-04-15 EP disclosed
US-20090029423-A1 METHOD FOR SEPARATING TARGET COMPONENT CANON KABUSHIKI KAISHA (JP) 2009-01-29 US disclosed
US-7459517-B2 Polyhydroxyalkanoate, process for preparing the same, and resin composition containing the polyhydroxyalkanoate CANON KABUSHIKI KAISHA (JP) 2008-12-02 US disclosed
EP-1254918-A2 Novel polyhydroxyalkanoate, producing method therefor, charge control agent containing such polyhydroxyalkanoate, toner containing such charge control agent and image forming method and image forming apparatus utilizing such toner CANON KABUSHIKI KAISHA (JP) 2002-11-06 EP disclosed
US-20020160467-A1 Polyhydroxyalkanoate and manufacturing method thereof CANON KABUSHIKI KAISHA (JP) 2002-10-31 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
EP-1245605-A2 Polyhydroxyalkanoate containing unit with thienyl structure in the side chain, process for its production, charge control agent, toner binder and toner which contain this polyhydroxyalkanoate, and image-forming method and image-forming apparatus which make use of the toner CANON KABUSHIKI KAISHA (JP) 2002-10-02 EP disclosed
EP-1236755-A2 Novel polyhydroxyalkanoate containing unit phenylsulfanyl structure in the side cahin, process for its production, charge control agent, toner binder and toner which contain novel polyhydroxyalkanoate, and imageforming apparatus which make use of the toner CANON KABUSHIKI KAISHA (JP) 2002-09-04 EP disclosed
EP-1236754-A2 Polyhydroxyalkanoate and method of producing same, and omega-(2-thienylsulfanyl) alkanoic acid and method of producing same CANON KABUSHIKI KAISHA (JP) 2002-09-04 EP disclosed
EP-1188782-A2 Polyhydroxyalkanoate and manufacturing method thereof CANON KABUSHIKI KAISHA (JP) 2002-03-20 EP disclosed