SCHEMBL461768

SCHEMBL461768

O=S(=O)(O)c1cc(S(=O)(=O)O)c2c(N=Nc3ccc(N=Nc4ccccc4)cc3)c(O)ccc2c1.[Na].[Na]

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.69
▸ MAPK1 P28482 3/20 0.68
▸ ALDH1A1 P00352 1/20 0.68
▸ SUMO2 P61956 1/20 0.65
▸ SUMO1 P63165 1/20 0.65
▸ SENP7 Q9BQF6 1/20 0.65
▸ SENP2 Q9HC62 1/20 0.65
▸ PHLPP2 Q6ZVD8 1/20 0.58
▸ CYP1A2 P05177 4/20 0.55
▸ CYP2C9 P11712 3/20 0.55
▸ PRMT1 Q99873 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ GAA P10253 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ POLB P06746 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ THRB P10828 2/20 0.49
▸ ENPP2 Q13822 3/20 0.48
▸ TSHR P16473 1/20 0.47

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
SCHEMBL1098585 1.00 APP (0.69) APPMAPK1ALDH1A1SUMO2SUMO1
SCHEMBL110351 1.00 APP (0.69) APPMAPK1ALDH1A1SUMO2SUMO1
SCHEMBL7921324 0.99 APP (0.67) APPMAPK1ALDH1A1SUMO2SUMO1
SCHEMBL10625306 0.99 APP (0.67) APPMAPK1ALDH1A1SUMO2SUMO1
Orange G SCHEMBL3020776 0.99 APP (0.70) APPMAPK1ALDH1A1SUMO2SUMO1
Orange G SCHEMBL31621938 0.99 APP (0.70) APPMAPK1ALDH1A1SUMO2SUMO1
Orange G SCHEMBL29388415 0.99 APP (0.70) APPMAPK1ALDH1A1SUMO2SUMO1
Orange G SCHEMBL17279088 0.99 APP (0.70) APPMAPK1ALDH1A1SUMO2SUMO1
Orange G SCHEMBL3020774 0.99 APP (0.70) APPMAPK1ALDH1A1SUMO2SUMO1
Orange G SCHEMBL3873347 0.99 APP (0.70) APPMAPK1ALDH1A1SUMO2SUMO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2930126-B1 Fashionable aerosol dye HENKEL AG & CO KGAA (DE) 2019-10-09 — — EP claimed
US-10259946-B1 Sealing agents, methods of making and uses thereof James Hardie Technology Limited (IE) 2019-04-16 — — US disclosed
US-9173829-B2 Compositions for dyeing keratin fibers HENKEL AG & CO. KGAA (DE) 2015-11-03 — — US disclosed
US-9161898-B2 Compositions for colouring keratin fibres HENKEL AG & CO. KGAA (DE) 2015-10-20 — — US disclosed
US-20140298592-A1 COMPOSITIONS FOR DYEING KERATIN FIBERS HENKEL AG & CO. KGAA (DE) 2014-10-09 — — US disclosed
US-20140290690-A1 COMPOSITIONS FOR COLOURING KERATIN FIBRES HENKEL AG & CO. KGAA (DE) 2014-10-02 — — US disclosed
US-8632612-B2 Compositions for dyeing keratin fibers SEGETIS, INC. (US) 2014-01-21 — — US disclosed
EP-2613760-A2 COMPOSITIONS FOR DYEING KERATIN FIBERS Segetis, Inc. (US) 2013-07-17 — — EP disclosed
US-20130156716-A1 COMPOSITIONS FOR DYEING KERATIN FIBERS SEGETIS, INC. (US) 2013-06-20 — — US disclosed
EP-2103299-B1 Oxidizing hair colourant compositions PROCTER & GAMBLE (US) 2013-02-27 — — EP disclosed
US-6485529-B1 Agent and method for coloring fibers WELLA AKTIENGESELLSCHAFT (DE) 2002-11-26 — — US disclosed
US-20020170125-A1 Bridged diaminopyrazole compounds and dye compositions containing same HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2002-11-21 — — US disclosed
US-6461390-B1 Process for making 2-aminomethyl-1, 4-diaminobenzene and its salts and compositions and methods for dyeing keratin fibers using same WELLA AKTIENGESELLSCHAFT (DE) 2002-10-08 — — US disclosed
US-6361571-B1 USING TAUTOMERIC NONOXIDATIVE DYES AND POLYMETHINE DYES WELLA AKTIENGESELLSCHAFT (DE) 2002-03-26 — — US disclosed
US-6171347-B1 REMOVAL OF HAIR COLOR TO BE WORN FOR ONLY A SHORT PERIOD OF TIME UNDER MILD, GENTLE CONDITIONS BY USING A COMBINATION OF A SUITABLE REDUCTONE, SUCH AS ASCORBIC ACID, AND/OR A THIOL AND/OR A SULFITE WELLA AKTIENGESELLSCHAFT (DE) 2001-01-09 — — US disclosed
US-6106579-A MIXTURE OF OXOCARBOXYLIC ACID AND REDUCING AGENT WELLA AKTIENGESELLSCHAFT (DE) 2000-08-22 — — US disclosed
US-4784959-A Method of detecting hydrocarbon fuel leaks LOCKHEED CORPORATION (US) 1988-11-15 — — US disclosed
US-4756854-A Method and apparatus for detecting hydrocarbon fuel leaks LOCKHEED CORPORATION (US) 1988-07-12 — — US disclosed
US-4745797-A Method and apparatus for detecting hydrocarbon fuel leaks LOCKHEED CORPORATION (US) 1988-05-24 — — US disclosed
US-4615828-A Method and apparatus for detecting hydrocarbon fuel leaks LOCKHEED CORPORATION (US) 1986-10-07 — — 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 (4 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-20140290690-A1 COMPOSITIONS FOR COLOURING KERATIN FIBRES KRT18, DSG1, PKN1 APP 2186/4885MAPK1 1485/4885ALDH1A1 2922/4885
US-20140298592-A1 COMPOSITIONS FOR DYEING KERATIN FIBERS KRT18, PKN3, IK APP 3465/4885MAPK1 2170/4885ALDH1A1 3708/4885
US-20130156716-A1 COMPOSITIONS FOR DYEING KERATIN FIBERS KRT18, KRTCAP2, JUP APP 1263/4885MAPK1 2748/4885ALDH1A1 1127/4885
US-20020170125-A1 Bridged diaminopyrazole compounds and dye compositions containing same ALK, DDC, CBR1 APP 3901/4885MAPK1 543/4885ALDH1A1 11/4885

“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.

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