SCHEMBL5033149

SCHEMBL5033149

O=S(=O)(O)c1c[c]c(O)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.43
MPL P40238 8/20 0.42
CYP1A2 P05177 1/20 0.41
LDHA P00338 1/20 0.40
CTRB1 P17538 1/20 0.40
CYP2D6 P10635 1/20 0.39
CTRC Q99895 1/20 0.39
COMT P21964 1/20 0.38
AURKA O14965 1/20 0.38
AURKB Q96GD4 1/20 0.38
NSD2 O96028 1/20 0.37
MMP14 P50281 1/20 0.37
CASP6 P55212 1/20 0.37
SUMO2 P61956 1/20 0.36
SUMO1 P63165 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP2 Q9HC62 1/20 0.36
SENP1 Q9P0U3 1/20 0.36
TNNI3 P19429 1/20 0.36
TNNT2 P45379 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
SCHEMBL6633977 0.85 TTR (0.43) TTRMPLCYP1A2LDHACTRB1
SCHEMBL3529903 0.83 LDHA (0.56) MPLLDHAHKDC1CDK2
SCHEMBL6632032 0.80 AURKA (0.45) TTRMPLCYP1A2CTRB1CYP2D6
SCHEMBL6631466 0.80 TTR (0.43) TTRMPLCYP1A2CTRB1CYP2D6
SCHEMBL11324661 0.79 TTR (0.50) TTRMPLCYP1A2LDHACTRB1
SCHEMBL6632477 0.79 ALDH1A1 (0.42) CYP1A2NSD2CASP6SUMO2SUMO1
SCHEMBL5031748 0.78 TTR (0.53) TTRMPLCYP1A2LDHACTRB1
SCHEMBL7554004 0.76 COMT (0.60) CYP1A2COMTNSD2
SCHEMBL29409575 0.74 TTR (0.61) TTRMPLCYP1A2LDHACTRB1
SCHEMBL703189 0.74 TTR (0.61) TTRMPLCYP1A2LDHACTRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0343262-B1 FIBRE-REACTIVE AZO DYES, PROCESS FOR THEIR PREPARATION AND THEIR USE FOR DYEING HYDROXY- AND/OR CARBOXAMIDE GROUPS CONTAINING FIBRE-MATERIAL HOECHST CELANESE CORPORATION (US) 1993-03-17 EP claimed
EP-0343262-A1 Fibre-reactive azo dyes, process for their preparation and their use for dyeing hydroxy- and/or carboxamide groups containing fibre-material HOECHST CELANESE CORPORATION (US) 1989-11-29 EP claimed
US-4564672-A Water-soluble monoazo and disazo compounds containing a fibre-reactive 2-alkoxy-5-chloro-aniline diazo component and copper complexes thereof, useful as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1986-01-14 US claimed
EP-0031508-B1 WATER-SOLUBLE AZO COMPOUNDS AND THEIR COPPER COMPLEXES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1984-05-09 EP claimed
EP-0031508-A2 Water-soluble azo compounds and their copper complexes, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-08 EP claimed
US-4199318-A Washfast disazo dyestuffs TOMS RIVER CHEMICAL CORPORATION (US) 1980-04-22 US claimed
US-4143035-A DISAZO DYESTUFFS HAVING AN ALKOXY GROUP ON THE FIRST AND/OR SECOND COMPONENT TOMS RIVER CHEMICAL CORPORATION (US) 1979-03-06 US claimed
US-20080241394-A1 Dyes and their use in ink-jet printing FUJIFILM IMAGING COLORANTS LIMITED 2008-10-02 US disclosed
US-20040231558-A1 Has a clear hue, high light fastness and high moisture resistance MITSUI CHEMICALS, INC. (JP) 2004-11-25 US disclosed
EP-1441013-A1 WATERCOLOR INK Mitsui Chemicals, Inc. (JP) 2004-07-28 EP disclosed
EP-0765965-B1 Process for deying synthetic fibrous polyamid materials DYSTAR TEXTILFARBEN GMBH & CO (DE) 2003-06-04 EP disclosed
US-6177552-B1 CONTAINING (((VINYLSULFONYL)ALKYLAMINO)ALKYLSULFONYL)PHENYLAZO GROUPS DYSTARTEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2001-01-23 US disclosed
EP-0765918-B1 Reactive dye preparations DYSTAR TEXTILFARBEN GMBH & CO (DE) 1999-07-28 EP disclosed
US-5803930-A MIXTURE OF TWO DIFFERENT WATER SOLUBLE DYES; DYEING SYNTHETIC POLYAMIDES DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-09-08 US disclosed
EP-0765918-A2 Reactive dye preparations DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1997-04-02 EP disclosed
EP-0765965-A2 Process for deying synthetic fibrous polyamid materials DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1997-04-02 EP disclosed
US-5373094-A Reactive dyes containing a 2,6-difluoro-3,5-dichloropyridine group ZENECA LIMITED (GB) 1994-12-13 US disclosed
EP-0576143-A2 Reactive dyes containing a 2,6-difluoro-3,5-dichloropyridine-4-ylamino group ZENECA LIMITED (GB) 1993-12-29 EP disclosed
US-4199318-A Washfast disazo dyestuffs TOMS RIVER CHEMICAL CORPORATION (US) 1980-04-22 US disclosed
US-4143035-A DISAZO DYESTUFFS HAVING AN ALKOXY GROUP ON THE FIRST AND/OR SECOND COMPONENT TOMS RIVER CHEMICAL CORPORATION (US) 1979-03-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080241394-A1 Dyes and their use in ink-jet printing TYR, IK, RB1 TTR 2242/4885MPL 807/4885CYP1A2 428/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.