SCHEMBL1131569

SCHEMBL1131569

COc1ccc(/N=N/c2n(C)cc[n+]2C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.41
RAB9A P51151 6/20 0.41
NPC1 O15118 4/20 0.41
MAPK1 P28482 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 3/20 0.41
PKM P14618 1/20 0.41
PTGS2 P35354 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.37
LMNA P02545 1/20 0.37
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.36
GFER P55789 1/20 0.36
GSK3B P49841 1/20 0.35
HDAC8 Q9BY41 3/20 0.35
NOS3 P29474 2/20 0.35
HTR3E A5X5Y0 1/20 0.35

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
SCHEMBL1131570 1.00 MAPT (0.41) MAPTRAB9ANPC1MAPK1MEN1
SCHEMBL20323029 1.00 MAPT (0.41) MAPTRAB9ANPC1MAPK1MEN1
Iodide SCHEMBL18063119 0.98 MAPT (0.40) MAPTRAB9ANPC1MAPK1MEN1
Hydrochloric Acid SCHEMBL338804 0.98 MAPT (0.40) MAPTRAB9ANPC1MAPK1MEN1
Hydrochloric Acid SCHEMBL338803 0.98 MAPT (0.40) MAPTRAB9ANPC1MAPK1MEN1
Iodide SCHEMBL18063120 0.98 MAPT (0.40) MAPTRAB9ANPC1MAPK1MEN1
Perchlorate SCHEMBL5860332 0.94 MAPT (0.41) MAPTRAB9ANPC1MAPK1MEN1
SCHEMBL6308287 0.94 MAPT (0.41) MAPTRAB9ANPC1MAPK1MEN1
SCHEMBL6308285 0.94 MAPT (0.41) MAPTRAB9ANPC1MAPK1MEN1
Perchlorate SCHEMBL5860330 0.94 MAPT (0.41) MAPTRAB9ANPC1MAPK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9855202-B2 Compositions for dyeing hair with cationic direct dyes NOXELL CORPORATION (US) 2018-01-02 US disclosed
US-9849072-B2 Method of coloring hair with direct dye compounds NOXELL CORPORATION (US) 2017-12-26 US disclosed
EP-2235114-B1 POLYMERIC HAIR DYES BASF SE (DE) 2017-07-26 EP disclosed
WO-2016146813-A1 CATIONIC DIRECT DYES BASF SE (DE) 2016-09-22 WO disclosed
US-20160271030-A1 Compositions for Dyeing Hair with Cationic Direct Dyes DEUTSCHE BANK TRUST COMPANY AMERICAS, AS COLLATERAL AGENT 2016-09-22 US disclosed
US-8992633-B2 Disulfide dyes BASF SE (DE) 2015-03-31 US disclosed
US-8962140-B2 Functionalized core-shell nanoparticles BASF SE (DE) 2015-02-24 US disclosed
US-20140157529-A1 DISULFIDE DYES BASF SE (DE) 2014-06-12 US disclosed
EP-2053094-B1 Composition for dyeing keratinous fibres comprising at least one direct dye with disulphur/thiol function and at least one polymer with thiol function and method using the composition OREAL (FR) 2014-03-26 EP disclosed
US-8641783-B2 Disulfide or thiol polymeric hair dyes BASF SE (DE) 2014-02-04 US disclosed
EP-1647580-A1 Dying composition comprising a particular disulfide dye and process of dying keratinous fibres with this dye. L'OREAL (FR) 2006-04-19 EP disclosed
EP-1609456-A1 Use of polycationic azo compounds for dyeing keratinous fibres L'OREAL (FR) 2005-12-28 EP disclosed
EP-1399117-A1 DYEING COMPOSITION FOR KERATINOUS FIBRES COMPRISING A PARTICULAR DICATIONIC DIAZO DYE L'OREAL (FR) 2004-03-24 EP disclosed
EP-1377265-A1 DYEING COMPOSITION FOR DYEING KERATINOUS FIBRES COMPRISING A CATIONIC AZO-DYE L'OREAL (FR) 2004-01-07 EP disclosed
EP-1377264-A1 DYEING COMPOSITION FOR DYEING KERATINOUS FIBRES COMPRISING A CATIONIC AZO-DYE L'OREAL (FR) 2004-01-07 EP disclosed
EP-1377262-A1 DYEING COMPOSITION FOR DYEING KERATINOUS FIBRES COMPRISING A CATIONIC AZO-DYE L'OREAL (FR) 2004-01-07 EP disclosed
WO-2002100368-A1 DYEING COMPOSITION FOR KERATINOUS FIBRES COMPRISING A PARTICULAR DICATIONIC DIAZO DYE L'OREAL (FR) 2002-12-19 WO disclosed
WO-2002078659-A1 DYEING COMPOSITION FOR DYEING KERATINOUS FIBRES COMPRISING A CATIONIC AZO-DYE L'OREAL (FR) 2002-10-10 WO disclosed
WO-2002078658-A1 DYEING COMPOSITION FOR DYEING KERATINOUS FIBRES COMPRISING A CATIONIC AZO-DYE L'OREAL (FR) 2002-10-10 WO disclosed
WO-2002078660-A1 DYEING COMPOSITION FOR DYEING KERATINOUS FIBRES COMPRISING A CATIONIC AZO-DYE L'OREAL (FR) 2002-10-10 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 (2 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-20140157529-A1 DISULFIDE DYES KRT18, COL1A1, SULT1A1 MAPT 1432/4885RAB9A 3890/4885NPC1 4274/4885
US-20160271030-A1 Compositions for Dyeing Hair with Cationic Direct Dyes TYR, SHH, COX5B MAPT 399/4885RAB9A 2176/4885NPC1 3494/4885

“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.