SCHEMBL8657140

SCHEMBL8657140

O=S(=O)(O)c1cccc(Nc2nc(F)nc(F)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.51
CA1 P00915 3/20 0.51
CA2 P00918 3/20 0.51
CA4 P22748 3/20 0.51
CA6 P23280 3/20 0.51
CA7 P43166 3/20 0.51
CA9 Q16790 3/20 0.51
CA14 Q9ULX7 3/20 0.51
CA13 Q8N1Q1 2/20 0.51
SNCA P37840 2/20 0.48
JAK2 O60674 2/20 0.44
JAK3 P52333 2/20 0.44
JAK1 P23458 1/20 0.44
TYK2 P29597 1/20 0.44
CA3 P07451 2/20 0.43
CA5A P35218 2/20 0.43
TNNI3K Q59H18 3/20 0.42
NSD2 O96028 1/20 0.42
DUSP3 P51452 1/20 0.42
PTPN5 P54829 1/20 0.42

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
SCHEMBL11429400 0.97 CA12 (0.48) CA12CA1CA2CA4CA6
SCHEMBL10490862 0.89 SNCA (0.54) CA12CA1CA2CA9SNCA
SCHEMBL10434095 0.86 CHAT (0.40) CA12CA1CA2CA4CA6
SCHEMBL4650680 0.86 SNCA (0.43) CA12CA1CA2CA4CA6
SCHEMBL9818585 0.86 TNNI3K (0.52) SNCAJAK2JAK3JAK1TYK2
SCHEMBL8951858 0.85 CHAT (0.48) CA12CA1CA2CA4CA6
SCHEMBL7755970 0.85 PRMT1 (0.53) CA12CA1CA2CA4CA6
SCHEMBL9009810 0.85 CA1 (0.59) CA12CA1CA2CA4CA6
SCHEMBL18421634 0.84 SNCA (0.62) CA12CA1CA2CA9SNCA
SCHEMBL9483352 0.84 CA1 (0.53) CA12CA1CA2CA4CA6

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5831039-A Fiber reactive polyazo dyes containing two urea groups DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-11-03 US disclosed
EP-0872523-A2 Fiber-reactive azo dyes, process for their preparation and the use thereof DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1998-10-21 EP disclosed
EP-0568816-B1 Symmetrical azo dyes BAYER AG (DE) 1996-06-26 EP disclosed
US-5493010-A FOR DYEING COTTON OR WOOL IN COLORFAST ORANGE, YELLOW OR BROWN SHADES BAYER AKTIENGESELLSCHAFT (DE) 1996-02-20 US disclosed
EP-0617089-A1 Fiber-reactive azo dyes BAYER AG (DE) 1994-09-28 EP disclosed
EP-0568816-A1 Symmetrical azo dyes BAYER AG (DE) 1993-11-10 EP disclosed
US-5116957-A REACTIVE AZO DYESTUFFS HAVING A FLUOROTRIAZINE GROUP AND IMPROVED FIXATION PROPERTIES BAYER AKTIENGESELLSCHAFT (DE) 1992-05-26 US disclosed
EP-0437920-A1 Reactive dyes ZENECA LIMITED (GB) 1991-07-24 EP disclosed
EP-0299328-B1 REACTIVE DYES BAYER AG (DE) 1991-07-10 EP disclosed
EP-0271656-B1 REACTIVE AMINO ALKOXY-TRIPHENE DIOXAZINE DYES BAYER AG (DE) 1990-08-01 EP disclosed
EP-0177978-B1 NAPHTHOL AMINE DERIVATIVES BAYER AG (DE) 1988-04-20 EP disclosed
US-4649193-A COTTON, WOOL, POLYAMIDES; COLOR-AND WASH FASTNESS HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-10 US disclosed
EP-0084314-B1 REACTIVE DISAZO DYES BAYER AG (DE) 1986-07-30 EP disclosed
EP-0085378-B1 COPPER COMPLEX DISAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1986-03-19 EP disclosed
US-4515598-A Process for dyeing and printing fiber materials containing hydroxy and/or carbonamide groups with reactive dye containing both vinyl sulphonyl and fluoro-triazinyl groups HOECHST AKTIENGESELLSCHAFT (DE) 1985-05-07 US disclosed
EP-0040790-B1 PROCESS FOR DYEING AND PRINTING TEXTILE MATERIALS CONTAINING HYDROXYL AND/OR CARBON-AMIDE GROUPS HOECHST AKTIENGESELLSCHAFT (DE) 1985-02-13 EP disclosed
EP-0085378-A2 Copper complex disazo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1983-08-10 EP disclosed
EP-0047863-A2 Reactive phthalocyanine hyes, process for their preparation and their use in dyeing materials containing hydroxyle groups and/or nitrogen BAYER AG (DE) 1982-03-24 EP disclosed
EP-0040790-A2 Process for dyeing and printing textile materials containing hydroxyl and/or carbon-amide groups HOECHST AKTIENGESELLSCHAFT (DE) 1981-12-02 EP disclosed
US-4189576-A Process for monoacylating water-soluble organic amino compounds CIBA-GEIGY CORPORATION (US) 1980-02-19 US disclosed