SCHEMBL6415587

SCHEMBL6415587

COC(=O)c1cccc([Na])c1S(=O)(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
CA5A P35218 1/20 0.46
TSHR P16473 2/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.43
CFTR P13569 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KMT2A Q03164 2/20 0.43
CA12 O43570 1/20 0.43
CA7 P43166 1/20 0.43
CA14 Q9ULX7 1/20 0.43
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
ATM Q13315 1/20 0.42
PTPRC P08575 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
FFAR4 Q5NUL3 1/20 0.40
MAPT P10636 1/20 0.39

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
SCHEMBL433518 0.88 CA1 (0.53) CA1CA2CA9CA5ATSHR
Water SCHEMBL27375204 0.86 CA1 (0.51) CA1CA2CA9CA5ATSHR
SCHEMBL4178504 0.86 CA1 (0.51) CA1CA2CA9CA5ATSHR
SCHEMBL3965219 0.86 CA1 (0.51) CA1CA2CA9CA5ATSHR
SCHEMBL27647423 0.86 CA1 (0.51) CA1CA2CA9CA5ATSHR
SCHEMBL375000 0.86 CA1 (0.51) CA1CA2CA9CA5ATSHR
SCHEMBL4968176 0.82 CA1 (0.38) CA1CA2CA9CA5ATSHR
Ethylene Glycol SCHEMBL6677269 0.81 KDM4E (0.49) CA1CA2CA9CA5ATSHR
SCHEMBL27544203 0.81 CA1 (0.47) CA1CA2CA9CA5ATSHR
SCHEMBL8591498 0.81 ALOX15 (0.50) CA1CA2CA9CA5ATSHR

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
US-5599782-A LOW MOLECULAR WEIGHT POLYESTER ANTISOILANTS THE PROCTER & GAMBLE COMPANY (US) 1997-02-04 US claimed
EP-0547106-B1 IMPROVED SOIL RELEASE AGENTS FOR GRANULAR LAUNDRY DETERGENTS PROCTER & GAMBLE (US) 1995-12-27 EP claimed
EP-0547106-A1 IMPROVED SOIL RELEASE AGENTS FOR GRANULAR LAUNDRY DETERGENTS. PROCTER & GAMBLE (US) 1993-06-23 EP claimed
WO-1992004433-A1 IMPROVED SOIL RELEASE AGENTS FOR GRANULAR LAUNDRY DETERGENTS THE PROCTER & GAMBLE COMPANY (US) 1992-03-19 WO claimed
JP-62146921-A None JP disclosed
JP-4283226-A None JP disclosed
US-20050130862-A1 Copolyesteramides and the use thereof as a soil release agent RHODIA CHIMIE (FR) 2005-06-16 US disclosed
US-5599782-A LOW MOLECULAR WEIGHT POLYESTER ANTISOILANTS THE PROCTER & GAMBLE COMPANY (US) 1997-02-04 US disclosed
EP-0547106-B1 IMPROVED SOIL RELEASE AGENTS FOR GRANULAR LAUNDRY DETERGENTS PROCTER & GAMBLE (US) 1995-12-27 EP disclosed
EP-0547106-A1 IMPROVED SOIL RELEASE AGENTS FOR GRANULAR LAUNDRY DETERGENTS. PROCTER & GAMBLE (US) 1993-06-23 EP disclosed
JP-H04283226-A MODIFIED POLYESTER FIBER TOYOBO CO LTD 1992-10-08 JP disclosed
WO-1992004433-A1 IMPROVED SOIL RELEASE AGENTS FOR GRANULAR LAUNDRY DETERGENTS THE PROCTER & GAMBLE COMPANY (US) 1992-03-19 WO disclosed
JP-S62146921-A CONTINUOUS PRODUCTION OF MODIFIED POLYESTER TEIJIN LTD 1987-06-30 JP disclosed