SCHEMBL7115648

SCHEMBL7115648

O=C(O)c1cccc(C(=O)OCC(O)O)c1S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
TSHR P16473 2/20 0.41
ALOX15 P16050 1/20 0.41
CYP2D6 P10635 1/20 0.35
ADRB2 P07550 8/20 0.35
ADRB1 P08588 8/20 0.35
ADRB3 P13945 8/20 0.35
CA2 P00918 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 1/20 0.34
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
NPY1R P25929 1/20 0.33
NPY2R P49146 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL19923810 0.86 ALDH1A1 (0.40) ALDH1A1TSHRADRB2ADRB1ADRB3
SCHEMBL7120234 0.85 ALDH1A1 (0.37) ALDH1A1TSHRALOX15ADRB2ADRB1
SCHEMBL7120240 0.83 TSHR (0.40) ALDH1A1TSHRALOX15CYP3A4L3MBTL1
SCHEMBL7124315 0.82 PRSS1 (0.36) ALDH1A1TSHRALOX15ADRB2ADRB1
SCHEMBL433519 0.82 TSHR (0.56) ALDH1A1TSHRALOX15CA2CYP3A4
SCHEMBL7124318 0.81 ALDH1A1 (0.43) ALDH1A1TSHRALOX15CYP3A4MAPT
SCHEMBL11516243 0.81 TSHR (0.54) ALDH1A1TSHRALOX15CA2CYP3A4
SCHEMBL2116927 0.81 ALOX15 (0.41) ALDH1A1TSHRALOX15CYP2D6CYP3A4
SCHEMBL6055475 0.81 TSHR (0.54) ALDH1A1TSHRALOX15CA2CYP3A4
SCHEMBL14720272 0.81 TSHR (0.54) ALDH1A1TSHRALOX15CA2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-59152924-A None JP disclosed
JP-60108422-A None JP disclosed
CN-108882764-A Artificial hair resin combination and its formed body 电化株式会社 2018-11-23 CN disclosed
CN-100585036-C Polyether ester elastic fiber and fabrics and clothes made by using the same TEIJIN FIBERS LTD 2010-01-27 CN disclosed
CN-100404735-C Polyether ester elastic fiber and fabric and clothing using the same TEIJIN FIBERS LTD (JP) 2008-07-23 CN disclosed
CN-101082140-A Polyether ester elastic fiber and fabrics and clothes made by using the same TEIJIN FIBERS LTD (JP) 2007-12-05 CN disclosed
CN-1809657-A Polyether ester elastic fiber and fabric and clothing using the same TEIJIN FIBERS LTD (JP) 2006-07-26 CN disclosed
EP-0669358-B1 BIODEGRADABLE COPOLYESTER, MOLDING PRODUCED THEREFROM, AND PROCESS FOR PRODUCING THE MOLDING KANEBO LTD (JP) 2003-11-19 EP disclosed
US-5593778-A FIBERS, FABRICS, LACTIC ACID, POLYETHYLENE GLYCOL, A DICARBOXYPHENYL SULFONATE MONOMER KANEBO, LTD. (JP) 1997-01-14 US disclosed
EP-0669358-A1 BIODEGRADABLE COPOLYESTER, MOLDING PRODUCED THEREFROM, AND PROCESS FOR PRODUCING THE MOLDING KANEBO LTD. (JP) 1995-08-30 EP disclosed
JP-S60108422-A MANUFACTURE OF MODIFIED POLYESTER MITSUBISHI RAYON CO LTD 1985-06-13 JP disclosed
EP-0121051-A1 Copolymeric nucleating agent for polyester GENERAL ELECTRIC COMPANY (US) 1984-10-10 EP disclosed
JP-S59152924-A PREPARATION OF MODIFIED POLYESTER MITSUBISHI RAYON CO LTD 1984-08-31 JP disclosed
US-4451606-A A POLYALKYLENE TEREPHTHALATE AND A SULFONATE SALT GENERAL ELECTRIC COMPANY (US) 1984-05-29 US disclosed