SCHEMBL4612186

SCHEMBL4612186

O=C(O)c1cc(OS)cc(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.44
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA7 P43166 3/20 0.44
CA9 Q16790 3/20 0.44
CA14 Q9ULX7 3/20 0.44
LCK P06239 1/20 0.43
FYN P06241 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TPMT P51580 3/20 0.42
CA3 P07451 2/20 0.42
CA4 P22748 2/20 0.42
CA6 P23280 2/20 0.42
CA5A P35218 2/20 0.42
CA5B Q9Y2D0 2/20 0.42
TP53 P04637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL22982 0.78 CA12 (0.65) CA12CA1CA2CA7CA9
SCHEMBL26189 0.78 CA12 (0.65) CA12CA1CA2CA7CA9
SCHEMBL29503492 0.77 MEN1 (0.58) CA12CA1CA2CA7CA9
SCHEMBL39734 0.75 CA1 (0.60) CA12CA1CA2CA7CA9
SCHEMBL4612700 0.75 USP2 (0.31) CA12CA1CA2CA7CA9
SCHEMBL23004950 0.74 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL1556954 0.74 CA12 (0.61) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL297134 0.74 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL21590118 0.74 CA12 (0.61) CA12CA1CA2CA7CA9
Benzene SCHEMBL20211008 0.74 CA12 (0.61) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3193916-A None JP disclosed
EP-1426395-B1 POLYTRIMETHYLENE TEREPHTHALATE POLYESTER TEIJIN LTD (JP) 2008-03-12 EP disclosed
US-7335719-B2 Polyester based on poly(trimethylene terephthalate) TEIJIN LIMITED (JP) 2008-02-26 US disclosed
EP-1304402-B1 POLYESTER FIBER TEIJIN LTD (JP) 2006-08-30 EP disclosed
US-20040116573-A1 Polyestrimethylene terephthalate polyester TEIJIN LIMITED (JP) 2004-06-17 US disclosed
EP-1426395-A1 POLYTRIMETHYLENE TEREPHTHALATE POLYESTER TEIJIN LIMITED (JP) 2004-06-09 EP disclosed
US-6740402-B2 HAVING RESISTANCES TO HYDROLYSIS AND FATIGUE FROM FLEXING AT HIGH LEVELS AND USABLE FOR APPLICATIONS OF PAPERMAKING CANVAS, TIRE CORD AND STERILIZED FABRICS TEIJIN LIMITED (JP) 2004-05-25 US disclosed
US-20030143397-A1 Having resistances to hydrolysis and fatigue from flexing at high levels and usable for applications of papermaking canvas, tire cord and sterilized fabrics TEIJIN LIMITED (JP) 2003-07-31 US disclosed
EP-1304402-A1 POLYESTER FIBER TEIJIN LIMITED (JP) 2003-04-23 EP disclosed
EP-0922726-B1 BIAXIALLY ORIENTED POLYETHYLENE NAPHTHALATE COPOLYMER FILM TEIJIN LTD (JP) 2003-03-26 EP disclosed
US-6048627-A PHOTOGRAPHY BASE FILM, FILMS FOR X-RAYS AND PHOTOENGRAVING TEIJIN LIMITED (JP) 2000-04-11 US disclosed
EP-0922726-A1 BIAXIALLY ORIENTED POLYETHYLENE NAPHTHALATE COPOLYMER FILM TEIJIN LIMITED (JP) 1999-06-16 EP disclosed
JP-H03193916-A CONJUGATE FIBER DYED WITH CATIONIC DYE TORAY IND INC 1991-08-23 JP disclosed