SCHEMBL7760682

SCHEMBL7760682

O=S(=O)(CCO)CCCNc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
ALDH1A1 P00352 2/20 0.53
KCNH3 Q9ULD8 5/20 0.41
CA2 P00918 4/20 0.41
CA12 O43570 3/20 0.41
CA9 Q16790 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
NCOR2 Q9Y618 1/20 0.38
CA1 P00915 2/20 0.37
RECQL P46063 1/20 0.37
MCL1 Q07820 1/20 0.37
LMNA P02545 2/20 0.36
GAA P10253 1/20 0.36
CDC25A P30304 1/20 0.36
HTT P42858 1/20 0.36
CA13 Q8N1Q1 1/20 0.36
RORC P51449 1/20 0.36

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
Hydrochloric Acid SCHEMBL8603722 0.98 MAPT (0.52) MAPTALDH1A1KCNH3CA2CA12
SCHEMBL8431544 0.89 ALDH1A1 (0.47) MAPTALDH1A1KCNH3CA2CA12
SCHEMBL8579361 0.83 CA12 (0.40) MAPTALDH1A1KCNH3CA2CA12
SCHEMBL4824936 0.83 PRSS1 (0.38) MAPTALDH1A1CA2CA12CA9
SCHEMBL7756165 0.83 ALDH1A1 (0.53) MAPTALDH1A1CA2CA12CA9
SCHEMBL8079295 0.82 DDX3X (0.41) MAPTALDH1A1CA2CA12CA9
Hydrochloric Acid SCHEMBL9412264 0.81 ALDH1A1 (0.52) MAPTALDH1A1KCNH3CA2CA12
SCHEMBL6477872 0.81 ALDH1A1 (0.47) MAPTALDH1A1KCNH3CA2CA12
SCHEMBL27413017 0.81 LMNA (0.47) MAPTALDH1A1CA2CA12CA9
Sulfuric Acid SCHEMBL1605645 0.80 MAPT (0.59) MAPTALDH1A1KCNH3CA2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0697443-B1 Triphendioxazine reactive dyes DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-04-04 EP disclosed
EP-0688831-B1 Watersoluble anthraquinone compounds, process for their manufacturing and their use as dyestuffs DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-04-04 EP disclosed
EP-0628606-B1 Triphendioxazine compounds, process for their preparation and their use as dyes DYSTAR TEXTILFARBEN GMBH & CO (DE) 2000-08-23 EP disclosed
EP-0741130-B1 Method for the preparation of sulphones BAYER AG (DE) 1999-12-01 EP disclosed
EP-0629667-B1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof HOECHST AG (DE) 1998-02-25 EP disclosed
US-5675040-A SULPHONE INTERMEDIATES, I.E., 2-ACETOXYETHYL-2'-HYDROXYETHYL SULPHONE FOR SYNTHESIS OF A FORMAZAN AND MONOAZO DYE BAYER AKTIENGESELLSCHAFT (DE) 1997-10-07 US disclosed
US-5663442-A REACTION OF SUBSTITUTED SULFONE WITH ANILINE OR SUBSTITUTED ANILINE, INTERMEDIATES FOR REACTIVE TRIAZINE DYES BAYER AKTIENGESELLSCHAFT (DE) 1997-09-02 US disclosed
US-5610298-A Water-soluble anthraquinone compounds, preparation thereof and use thereof as dyes HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-11 US disclosed
EP-0741130-A1 Method for the preparation of sulphones BAYER AG (DE) 1996-11-06 EP disclosed
US-5569748-A DYE COTTON IN LIGHTFAST RED SHADES HOECHST AKTIENGESELLSCHAFT (DE) 1996-10-29 US disclosed
US-5539088-A PROVIDE DYEINGS IN BRILLIANT SHADES WITH GOOD FASTNESS PROPERTIES AND HIGH DEGREE OF FIXATION HOECHST AKTIENGESELLSCHAFT (DE) 1996-07-23 US disclosed
EP-0697443-A2 Triphendioxazine reactive dyes HOECHST AKTIENGESELLSCHAFT (DE) 1996-02-21 EP disclosed
US-5484458-A POLYAMIDES OR CELLULOSE FIBERS HOECHST AKTIENGESELLSCHAFT (DE) 1996-01-16 US disclosed
EP-0688831-A1 Watersoluble anthraquinone compounds, process for their manufacturing and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1995-12-27 EP disclosed
EP-0636665-A1 Water-soluble azo-compounds, process of their production and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1995-02-01 EP disclosed
EP-0629667-A1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1994-12-21 EP disclosed
EP-0628606-A1 Triphendioxazine compounds, process for their preparation and their use as dyes HOECHST AKTIENGESELLSCHAFT (DE) 1994-12-14 EP disclosed