SCHEMBL9149809

SCHEMBL9149809

Nc1ccc2cccc(S(=O)(=O)CCO)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTDSP1 Q9GZU7 1/20 0.47
CA2 P00918 7/20 0.43
HTR6 P50406 1/20 0.42
APEX1 P27695 1/20 0.41
NT5E P21589 1/20 0.38
CA1 P00915 1/20 0.38
CA9 Q16790 1/20 0.38
PLAU P00749 1/20 0.37
F2 P00734 1/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
ALDH1A1 P00352 3/20 0.35
HSD17B10 Q99714 3/20 0.35
CYP3A4 P08684 2/20 0.35
TDP1 Q9NUW8 2/20 0.34
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HBB P68871 1/20 0.34

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
SCHEMBL9501266 0.88 PLAU (0.47) CTDSP1CA2HTR6APEX1NT5E
SCHEMBL13989415 0.86 CTDSP1 (0.41) CTDSP1CA2HTR6APEX1NT5E
SCHEMBL11696503 0.85 CTDSP1 (0.44) CTDSP1CA2HTR6APEX1NT5E
SCHEMBL11696205 0.85 CTDSP1 (0.44) CTDSP1CA2HTR6APEX1NT5E
SCHEMBL11692926 0.83 CTDSP1 (0.43) CTDSP1CA2HTR6APEX1NT5E
SCHEMBL7628352 0.83 CTDSP1 (0.43) CTDSP1CA2HTR6APEX1NT5E
SCHEMBL10626413 0.81 NT5E (0.47) CTDSP1CA2NT5EALDH1A1HSD17B10
SCHEMBL9097803 0.80 CA1 (0.53) CA2HTR6APEX1CA1CA9
SCHEMBL11426051 0.80 APEX1 (0.49) CA2HTR6APEX1TDP1
SCHEMBL11692932 0.80 CTDSP1 (0.40) CTDSP1CA2HTR6APEX1NT5E

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
US-5463100-A Spraying a mixture of an aminoaryl beta-hydroxyethylsulfone and sulfuric acid into a hot gas stream; drying, esterification and any hydrolysis take place simultaneously; granules HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
EP-0384265-B1 PROCESS FOR THE PREPARATION OF BETA-CHLOROETHYL SULFONYL ARYL ISOCYANATES HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-31 EP disclosed
EP-0390826-B1 PROCESS FOR PRODUCING AMINOARYL-BETA-SULPHATOETHYLSULPHONE COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1992-11-19 EP disclosed
EP-0292904-B1 WATER SOLUBLE NAPHTYL-AZO-PYRAZOLON COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYES HOECHST AKTIENGESELLSCHAFT (DE) 1992-02-12 EP disclosed
US-4963661-A MONOAZO DYES; FAST YELLOW TO ORANGE HUES HOECHST AKTIENGESELLSCHAFT (DE) 1990-10-16 US disclosed
EP-0384265-A1 Process for the preparation of beta-chloroethyl sulfonyl aryl isocyanates HOECHST AKTIENGESELLSCHAFT (DE) 1990-08-29 EP disclosed
US-4948917-A REACTING PHOSGENE AND BETA-HYDROXYETHYLSULFONYL-ARYLAMINE HOECHST AKTIENGESELLSCHAFT (DE) 1990-08-14 US disclosed
EP-0292904-A2 Water soluble naphtyl-azo-pyrazolon compounds, process for their preparation and their use as dyes HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-30 EP disclosed
US-4745187-A Process for the preparation of water-soluble phthalocyanine dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1988-05-17 US disclosed
US-4485041-A Water-soluble metal free or copper triazino-bis-[hydroxy-naphthylamino]-disazo dyestuffs containing fiber reactive groups, and a process for dyeing or printing cellulose fibers HOECHST AKTIENGESELLSCHAFT (DE) 1984-11-27 US disclosed
US-4482501-A REACTING AN AMINOARYL- OR AMIDOARYL-B- HYDROXYLETHYLSULFONE WITH SULFURIC ACID SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-11-13 US disclosed
US-4346046-A FROM AMINOARYL-B-HYDROXYETHYLSULFONE AND SULFURIC ACID SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-08-24 US disclosed
US-4323497-A Water-soluble disazo dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1982-04-06 US disclosed
US-4045428-A Water-soluble reactive naphthylazonaphthyl dyestuffs HOECHST AKTIENGESELLSCHAFT (DT) 1977-08-30 US disclosed