SCHEMBL6360010

SCHEMBL6360010

O=C(O)CC(O)CC(Cl)(Cl)S(=O)(=O)c1cccs1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.41
MMP9 P14780 1/20 0.41
MMP13 P45452 1/20 0.41
PKM P14618 1/20 0.40
TSHR P16473 1/20 0.40
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
ALDH1A1 P00352 4/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TP53 P04637 1/20 0.35
POLB P06746 2/20 0.34
F2 P00734 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 1/20 0.33

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
SCHEMBL6354628 0.87 MMP13 (0.39) MMP1MMP9MMP13PKMTSHR
SCHEMBL6348848 0.81 MMP1 (0.42) MMP1MMP9MMP13PKMTSHR
SCHEMBL5685846 0.79 MMP12 (0.39) MMP9MMP13TSHRALDH1A1CYP2C19
SCHEMBL6351035 0.76 PKM (0.40) MMP1MMP9MMP13PKMTSHR
SCHEMBL6354324 0.76 TSHR (0.44) MMP1MMP9MMP13PKMTSHR
SCHEMBL6353062 0.75 PKM (0.42) PKMTSHRSLC1A3SLC1A2SLC1A1
SCHEMBL6359159 0.73 RAB9A (0.47) MMP9MMP13PKMTSHRSLC1A3
SCHEMBL5685835 0.72 KDM4E (0.41) MMP1MMP9MMP13ALDH1A1CYP2C9
SCHEMBL5681991 0.72 LMNA (0.38) MMP1MMP9MMP13SLC1A3SLC1A2
SCHEMBL6351605 0.71 RAB9A (0.45) MMP9MMP13PKMTSHRSLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6855472-B2 POLYHYDROXYALKANOATE, PRODUCING METHOD THEREFOR, CHARGE CONTROL AGENT CONTAINING SUCH POLYHYDROXYALKANOATE, TONER CONTAINING SUCH CONTROL AGENT AND IMAGE FORMING METHOD AND IMAGE FORMING APPARATUS UTILIZING SUCH TONER CANON KABUSHIKI KAISHA (JP) 2005-02-15 US disclosed
EP-1254918-B1 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 KK (JP) 2004-03-31 EP disclosed
US-20030073804-A1 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) 2003-04-17 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