SCHEMBL5708680

SCHEMBL5708680

Cc1cc(N)c(Cl)cc1S(=O)(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.45
TP53 P04637 1/20 0.45
CREBBP Q92793 1/20 0.45
ALDH1A1 P00352 3/20 0.44
RECQL P46063 2/20 0.44
CYP3A4 P08684 1/20 0.44
THRB P10828 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
CASP1 P29466 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CD44 P16070 1/20 0.43
GAA P10253 3/20 0.41
CA12 O43570 6/20 0.37
CA1 P00915 6/20 0.37
CA2 P00918 6/20 0.37
CA9 Q16790 6/20 0.37
CA4 P22748 2/20 0.37
CA6 P23280 2/20 0.37

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
SCHEMBL4993146 0.92 BRD4 (0.45) BRD4TP53CREBBPALDH1A1RECQL
SCHEMBL315975 0.85 CD44 (0.54) BRD4TP53CREBBPALDH1A1RECQL
SCHEMBL29350461 0.85 CD44 (0.54) BRD4TP53CREBBPALDH1A1RECQL
SCHEMBL9515282 0.84 CD44 (0.44) BRD4TP53CREBBPALDH1A1RECQL
SCHEMBL3824812 0.84 BRD4 (0.50) BRD4TP53CREBBPALDH1A1RECQL
SCHEMBL30092569 0.84 BRD4 (0.50) BRD4TP53CREBBPALDH1A1RECQL
SCHEMBL9327134 0.84 ALDH1A1 (0.50) TP53ALDH1A1RECQLCYP3A4THRB
SCHEMBL27990790 0.83 CD44 (0.52) BRD4TP53CREBBPALDH1A1RECQL
SCHEMBL1755154 0.82 BRD4 (0.49) BRD4TP53CREBBPALDH1A1RECQL
SCHEMBL1708535 0.82 GAA (0.52) ALDH1A1RECQLCYP3A4THRBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0077537-B1 PROCESS FOR PREPARING 6-CHLORO-3-TOLUIDINO-4-SULPHONIC ACID HOECHST AKTIENGESELLSCHAFT (DE) 1985-10-02 EP claimed
EP-0077537-A2 Process for preparing 6-chloro-3-toluidino-4-sulphonic acid HOECHST AKTIENGESELLSCHAFT (DE) 1983-04-27 EP claimed
JP-54151945-A None JP disclosed
JP-55004335-A None JP disclosed
EP-1160292-B1 Colouration of inorganic fertilisers K & S AG (DE) 2006-10-11 EP disclosed
EP-1160292-A2 Colouration of inorganic fertilisers K+S Aktiengesellschaft (DE) 2001-12-05 EP disclosed
EP-0712914-B1 Calcined pencil leads and method of manufacturing the same MITSUBISHI PENCIL CO (JP) 2000-02-09 EP disclosed
US-5645629-A Calcined pencil leads and method of manufacturing the same MITSUBISHI PENCIL KABUSHIKI KAISHA (JP) 1997-07-08 US disclosed
EP-0712914-A2 Calcined pencil leads and method of manufacturing the same MITSUBISHI PENCIL KABUSHIKI KAISHA (JP) 1996-05-22 EP disclosed
US-4767844-A COUPLING DIAZO COMPONENT HAVING SULFONIC ACID GROUP WITH A MIXTURE OF 2-HYDROXY-3-NAPHTHOIC ACID AND THE AMIDE DERIVATIVES THEREOF DAINIPPON INK AND CHEMICALS, INC. (JP) 1988-08-30 US disclosed
EP-0202906-A1 Process for producing azo lake pigments DAINIPPON INK AND CHEMICALS, INC. (JP) 1986-11-26 EP disclosed
EP-0077537-B1 PROCESS FOR PREPARING 6-CHLORO-3-TOLUIDINO-4-SULPHONIC ACID HOECHST AKTIENGESELLSCHAFT (DE) 1985-10-02 EP disclosed
EP-0077537-B1 PROCESS FOR PREPARING 6-CHLORO-3-TOLUIDINO-4-SULPHONIC ACID HOECHST AKTIENGESELLSCHAFT (DE) 1985-10-02 EP disclosed
EP-0077537-A2 Process for preparing 6-chloro-3-toluidino-4-sulphonic acid HOECHST AKTIENGESELLSCHAFT (DE) 1983-04-27 EP disclosed
EP-0077537-A2 Process for preparing 6-chloro-3-toluidino-4-sulphonic acid HOECHST AKTIENGESELLSCHAFT (DE) 1983-04-27 EP disclosed
EP-0077537-A2 Process for preparing 6-chloro-3-toluidino-4-sulphonic acid HOECHST AKTIENGESELLSCHAFT (DE) 1983-04-27 EP disclosed
JP-S554335-A TREATMENT OF WASTE SULFURIC ACID CONTAINING TOLUENESULFONIC ACID DERIVATIVE CHISSO CORP 1980-01-12 JP disclosed
JP-S54151945-A PREPARATION OF 6-CHLORO-3-TOLUIDINE-4-SULFONIC ACID HODOGAYA CHEM CO LTD 1979-11-29 JP disclosed
US-4048154-A POLYAMIDE FIBERS BAYER AKTIENGESELLSCHAFT (DT) 1977-09-13 US disclosed
US-4014866-A FOR SURFACE COATINGS, PRINTING INKS AND RESINS BASF AKTIENGESELLSCHAFT (DT) 1977-03-29 US disclosed