SCHEMBL9178147

SCHEMBL9178147

Nc1cccc2c(S(=O)(=O)CCOS(=O)(=O)O)cccc12

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.58
APEX1 P27695 1/20 0.47
NSD2 O96028 15/20 0.44
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CDK2 P24941 1/20 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
SCHEMBL9177053 0.91 TTR (0.46) TTRAPEX1NSD2
SCHEMBL5702875 0.85 TTR (0.44) TTRAPEX1NSD2CDK2
SCHEMBL9808418 0.84 APEX1 (0.44) TTRAPEX1NSD2ALDH1A1TSHR
SCHEMBL1170678 0.84 KYNU (0.47) TTRAPEX1NSD2ALDH1A1HSD17B10
SCHEMBL9776594 0.84 TTR (0.47) TTRAPEX1NSD2ALDH1A1TSHR
SCHEMBL8075768 0.82 TTR (0.39) TTRAPEX1ALDH1A1CYP3A4HPGD
SCHEMBL7963753 0.81 CA1 (0.47) APEX1ALDH1A1CYP3A4TSHRHSD17B10
SCHEMBL9498944 0.81 TTR (0.61) TTRAPEX1NSD2ALDH1A1CYP3A4
SCHEMBL3481099 0.78 TTR (0.41) TTRAPEX1ALDH1A1TSHRHSD17B10
SCHEMBL7624190 0.77 PLAU (0.43) TTRAPEX1NSD2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5463031-A Printing, dyeing cellulose and organonitrogen compounds BAYER AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
US-5102993-A Useful in one phase printing due to stability in alkaline printing pastes and high color yield HOECHST AKTIENGESELLSCHAFT (DE) 1992-04-07 US disclosed
US-5003053-A Water-soluble monoazo compounds containing a p-aminophenylamino- and chloro- or fluoro-substituted triazinylamino group and a fiber-reactive group selected from the vinylsulfone series, suitable as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1991-03-26 US disclosed
US-4902786-A Phenylazonaphthol or naphthylazonaphthol compounds containing a fibre-reactive aminophenylamino-substituted halogen-s-triazinylamino group and a fibre-reactive group of the vinylsulfone series, suitable as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1990-02-20 US disclosed
US-4775746-A Water-soluble monoazo compounds containing a fiber-reactive group of the vinylsulfone series and having a sulfonaphthol coupling component with a phenylaminotriazinylamino substituent, suitable as dyestuffs HOECHST AKTIENGESELLSHAFT (DE) 1988-10-04 US disclosed
US-4757136-A Water-soluble Azo compounds containing fiber-reactive groups and having a sulfo-naphthol coupling component with a triazinylamino substituent suitable as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1988-07-12 US disclosed
US-4740592-A Water-soluble azo compounds containing fiber-reactive groups and having a sulfo-naphthal coupling component with a triazinylamino substituent suitable as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1988-04-26 US disclosed
US-4731441-A Water-soluble azo compounds containing, as fiber-reactive groups, a (nitrophenylamino-phenylamino)-chloro-triazinylamino group and groups of the vinylsulfone series, suitable as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1988-03-15 US disclosed
US-4703111-A Water-soluble compounds containing one or two (nitrophenylamino)-phenylamino-chlorotriazinylamino groups, the nitrophenylamino being additionally substituted by a fiber-reactive group of the vinylsulfonyl series, suitable as dyestuffs HOECHST AKTIENGESELLSCHAFT A CORP. OF GERMANY (DE) 1987-10-27 US disclosed
US-4701523-A Water-soluble disazo compounds containing one or two (nitro-phenylamino)-phenylamino-chlorotriazinylamino groups, the nitro-phenylamino being additionally substituted by a fiber-reactive group of the vinylsulfone series, suitable as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1987-10-20 US disclosed
US-4659807-A Water-soluble pyridone monoazo compounds suitable as fiber reactive dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1987-04-21 US disclosed