SCHEMBL14938732

SCHEMBL14938732

CN(CCOS(=O)(=O)[O-])c1ccc(N=Nc2sc3ccccc3[n+]2C)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ INSR P06213 4/20 0.60
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ ALDH1A1 P00352 5/20 0.36
▸ HPGD P15428 3/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ PKM P14618 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ CA12 O43570 3/20 0.36
▸ CA2 P00918 3/20 0.36
▸ CA9 Q16790 3/20 0.36
▸ MMP14 P50281 1/20 0.33
▸ RAB9A P51151 5/20 0.33
▸ POLB P06746 4/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 4/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ NPC1 O15118 2/20 0.32
▸ MAPK1 P28482 2/20 0.32

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
SCHEMBL15969807 0.92 INSR (0.62) INSRMEN1KMT2AALDH1A1HPGD
SCHEMBL14950371 0.90 INSR (0.60) INSRMEN1KMT2AALDH1A1HPGD
SCHEMBL14938639 0.88 INSR (0.55) INSRMEN1KMT2AALDH1A1HPGD
SCHEMBL14938551 0.86 INSR (0.55) INSRMEN1KMT2AALDH1A1HPGD
SCHEMBL16180826 0.86 INSR (0.60) INSRMEN1KMT2AALDH1A1HPGD
SCHEMBL14938756 0.85 INSR (0.44) INSRMEN1KMT2AALDH1A1HPGD
SCHEMBL8388983 0.82 INSR (0.77) INSRMEN1KMT2AALDH1A1HPGD
SCHEMBL12258217 0.80 INSR (0.61) INSRALDH1A1MMP14HSD17B10MAPK1
SCHEMBL15970602 0.80 INSR (0.57) INSRMEN1KMT2AALDH1A1HPGD
SCHEMBL14941470 0.78 KMT2A (0.56) INSRMEN1KMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2776000-B1 ZWITTERIONIC AZO DYESTUFFS FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO KGAA (DE) 2016-03-02 — — EP claimed
US-8864848-B2 Zwitterionic azo dyestuffs for coloring keratin-including fibres HENKEL AG & CO. KGAA (DE) 2014-10-21 — — US claimed
EP-2776000-A1 ZWITTERIONIC AZO DYESTUFFS FOR COLOURING KERATIN-CONTAINING FIBRES Henkel AG & Co. KGaA (DE) 2014-09-17 — — EP claimed
US-20140237735-A1 ZWITTERIONIC AZO DYESTUFFS FOR COLOURING KERATIN-INCLUDING FIBRES HENKEL AG & CO. KGAA (DE) 2014-08-28 — — US claimed
WO-2013068223-A1 ZWITTERIONIC AZO DYESTUFFS FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO. KGAA (DE) 2013-05-16 — — WO claimed
EP-2776000-B1 ZWITTERIONIC AZO DYESTUFFS FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO KGAA (DE) 2016-03-02 — — EP disclosed
US-9029362-B2 Iminothiadiazine dioxide compounds as brace inhibitors, compositions, and their use MERCK SHARP & DOHME CORP. (US) 2015-05-12 — — US disclosed
US-8864848-B2 Zwitterionic azo dyestuffs for coloring keratin-including fibres HENKEL AG & CO. KGAA (DE) 2014-10-21 — — US disclosed
EP-2776000-A1 ZWITTERIONIC AZO DYESTUFFS FOR COLOURING KERATIN-CONTAINING FIBRES Henkel AG & Co. KGaA (DE) 2014-09-17 — — EP disclosed
US-20140237735-A1 ZWITTERIONIC AZO DYESTUFFS FOR COLOURING KERATIN-INCLUDING FIBRES HENKEL AG & CO. KGAA (DE) 2014-08-28 — — US disclosed
WO-2013068223-A1 ZWITTERIONIC AZO DYESTUFFS FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO. KGAA (DE) 2013-05-16 — — WO 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-20140237735-A1 ZWITTERIONIC AZO DYESTUFFS FOR COLOURING KERATIN-INCLUDING FIBRES KRT18, IK, ZW10 INSR 4377/4885MEN1 1358/4885KMT2A 190/4885

“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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