SCHEMBL3860682

SCHEMBL3860682

O=S(=O)(O)c1ccc(N=NNc2ccccc2)cc1.[NaH]

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.70
▸ KMT2A Q03164 7/20 0.70
▸ POLB P06746 1/20 0.64
▸ CYP2D6 P10635 1/20 0.64
▸ CYP1B1 Q16678 4/20 0.59
▸ CYP1A1 P04798 3/20 0.59
▸ TSHR P16473 2/20 0.59
▸ TDP1 Q9NUW8 1/20 0.59
▸ RAB9A P51151 6/20 0.56
▸ SMN1; SMN2 Q16637 5/20 0.56
▸ MAPT P10636 4/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ CASP3 P42574 2/20 0.56
▸ SENP8 Q96LD8 2/20 0.56
▸ SENP7 Q9BQF6 2/20 0.56
▸ SENP6 Q9GZR1 2/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ NPC1 O15118 5/20 0.56
▸ HPGD P15428 2/20 0.54
▸ SNCA P37840 1/20 0.43

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
SCHEMBL2777355 0.98 MEN1 (0.72) MEN1KMT2APOLBCYP2D6CYP1B1
SCHEMBL27918619 0.92 MEN1 (0.73) MEN1KMT2APOLBCYP2D6CYP1B1
SCHEMBL27918752 0.92 MEN1 (0.73) MEN1KMT2APOLBCYP2D6CYP1B1
SCHEMBL5351043 0.90 MEN1 (0.84) MEN1KMT2APOLBCYP2D6CYP1B1
SCHEMBL5353261 0.90 MEN1 (0.84) MEN1KMT2APOLBCYP2D6CYP1B1
SCHEMBL11062547 0.82 POLB (0.71) MEN1KMT2APOLBCYP2D6TSHR
SCHEMBL1741555 0.82 CYP1B1 (0.61) MEN1KMT2APOLBCYP2D6CYP1B1
SCHEMBL22062156 0.81 KMT2A (0.60) MEN1KMT2APOLBCYP2D6CYP1B1
SCHEMBL460752 0.80 POLB (0.73) MEN1KMT2APOLBCYP2D6TSHR
SCHEMBL460751 0.80 POLB (0.73) MEN1KMT2APOLBCYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1961451-B1 Dyes for keratinic fibers comprising a special anionic thickener Wella GmbH (DE) 2016-02-24 — — EP disclosed
US-7591862-B2 bleaching hair with a mixture of oxidative dye and an anionic acrylic thickener Sodium Acrylate/Sodium Acryloyldimethyl Taurate Copolymer, providing good miscibility, good adhesion properties to colorants and bleaching compositions THE PROCTER & GAMBLE COMPANY (US) 2009-09-22 — — US disclosed
US-7553337-B2 Hair colorants for simultaneous dyeing and brightening of keratin fibers WELLA AG (DE) 2009-06-30 — — US disclosed
US-7544215-B2 Neutral and cationic naphthalene and colorants for keratin fibers containing these compounds WELLA AG (DE) 2009-06-09 — — US disclosed
US-7488353-B2 Cationic heteroarylazine dyes and colorants containing these compounds WELLA AG (DE) 2009-02-10 — — US disclosed
US-7452385-B2 Naphthalene derivatives and colorants for keratin fibers containing these compounds WELLA AG (DE) 2008-11-18 — — US disclosed
US-7431741-B2 Brightening colorant with indolythiazolium dyes WELLA AG (DE) 2008-10-07 — — US disclosed
WO-2008102310-A1 DYES FOR KERATINIC FIBERS COMPRISING A SPECIAL ANIONIC THICKENER THE PROCTER & GAMBLE COMPANY (US) 2008-08-28 — — WO disclosed
EP-1961450-A1 Dyes for keratinic fibers comprising a special anionic thickener Wella Aktiengesellschaft (DE) 2008-08-27 — — EP disclosed
EP-1961451-A1 Dyes for keratinic fibers comprising a special anionic thickener Wella Aktiengesellschaft (DE) 2008-08-27 — — EP disclosed
US-20080196174-A1 Dyes for Keratinic Fibers Comprising a Special Anionic Thickener WELLA OPERATIONS US, LLC 2008-08-21 — — US disclosed
US-20070180631-A1 Brightening colorant with indolythiazolium dyes Wella GmbH (DE) 2007-08-09 — — US disclosed
US-20070174975-A1 Cationic heteroarylazine dyes and colorants containing these compounds Wella GmbH (DE) 2007-08-02 — — US disclosed
US-20070169284-A1 HAIR COLORANTS FOR SIMULTANEOUS DYEING AND BRIGHTENING OF KERATIN FIBERS HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2007-07-26 — — US disclosed
US-20070157398-A1 Novel naphthalene derivatives and colorants for keratin fibers containing these compounds Wella GmbH (DE) 2007-07-12 — — US disclosed
US-20070151046-A1 Neutral and cationic naphthalene and colorants for keratin fibers containing these compounds Wella GmbH (DE) 2007-07-05 — — 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 (5 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-20070180631-A1 Brightening colorant with indolythiazolium dyes KRT18, TUBB1, IK MEN1 3259/4885KMT2A 1177/4885POLB 680/4885
US-20070169284-A1 HAIR COLORANTS FOR SIMULTANEOUS DYEING AND BRIGHTENING OF KERATIN FIBERS KRT18, TUBB1, TUBB MEN1 2966/4885KMT2A 1652/4885POLB 1204/4885
US-20070151046-A1 Neutral and cationic naphthalene and colorants for keratin fibers containing these compounds KRT18, NUP205, KPNA1 MEN1 2181/4885KMT2A 2261/4885POLB 1435/4885
US-20070174975-A1 Cationic heteroarylazine dyes and colorants containing these compounds KRT18, IK, CRYZ MEN1 4339/4885KMT2A 591/4885POLB 1984/4885
US-20070157398-A1 Novel naphthalene derivatives and colorants for keratin fibers containing these compounds KRT18, KPNA1, KPNB1 MEN1 3922/4885KMT2A 1744/4885POLB 2239/4885

“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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