SCHEMBL5201964

SCHEMBL5201964

O=[N+]([O-])c1ccc(NCCO)c(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.65
TSHR P16473 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
MEN1 O00255 7/20 0.57
MAPT P10636 7/20 0.57
PKM P14618 4/20 0.57
HTT P42858 1/20 0.57
ALDH1A1 P00352 9/20 0.56
LMNA P02545 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.55
HSD17B10 Q99714 1/20 0.51
GAA P10253 1/20 0.51

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
SCHEMBL29567126 1.00 KMT2A (0.65) KMT2ATSHRTDP1MEN1MAPT
SCHEMBL113357 0.88 KMT2A (0.61) KMT2ATSHRTDP1MEN1MAPT
SCHEMBL29390514 0.85 KMT2A (0.70) KMT2ATSHRTDP1MEN1MAPT
SCHEMBL126989 0.85 KMT2A (0.70) KMT2ATSHRTDP1MEN1MAPT
SCHEMBL532227 0.85 KMT2A (0.52) KMT2ATSHRTDP1MEN1MAPT
SCHEMBL532226 0.85 KMT2A (0.52) KMT2ATSHRTDP1MEN1MAPT
SCHEMBL10653490 0.84 MEN1 (0.57) KMT2AMEN1MAPTPKMHTT
SCHEMBL17538567 0.84 MEN1 (0.57) KMT2AMEN1MAPTPKMHTT
SCHEMBL109470 0.83 KMT2A (0.67) KMT2ATSHRTDP1MEN1MAPT
SCHEMBL563763 0.83 PKM (0.67) KMT2ATSHRTDP1MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1903161-A Composition for simultaneously bleaching and coloring of keratin fibres comprising an anionic or non-ionic dye and an asociative polymer OREAL (FR) 2007-01-31 CN claimed
CN-1899244-A Agent for simultaneously bleaching and coloring of keratin fibres comprising an anionic or non-ionic dye and an inert organic liquid OREAL (FR) 2007-01-24 CN claimed
US-9504637-B2 Coloring agents and methods of use thereof LIVING PROOF, INC. (US) 2016-11-29 US disclosed
US-9504637-B2 Coloring agents and methods of use thereof LIVING PROOF, INC. (US) 2016-11-29 US disclosed
US-20160106648-A1 COLORING AGENTS AND METHODS OF USE THEREOF LIVING PROOF, INC. (US) 2016-04-21 US disclosed
US-20160106648-A1 COLORING AGENTS AND METHODS OF USE THEREOF LIVING PROOF, INC. (US) 2016-04-21 US disclosed
CN-102018636-B Usage of drying oil for wash-protecting the color of artificially dyed keratin fibers OREAL 2012-12-26 CN disclosed
CN-102481235-A Cosmetic composition for keratin fibers OREAL 2012-05-30 CN disclosed
CN-102018636-A Usage of drying oil for wash-protecting the color of artificially dyed keratin fibers OREAL 2011-04-20 CN disclosed
CN-101327171-A Dyeing processes comprising at least one multi-carbosite, multi-group coupling agent for wash-protecting the color of artificially dyed keratin fibers OREAL (FR) 2008-12-24 CN disclosed
CN-101057818-A Use of a cosmetic composition for improving the colour of artificially dyed keratinous fibres. OREAL (FR) 2007-10-24 CN disclosed
EP-1819682-A1 SYMMETRICAL CATIONIC TETRAAZO COMPOUNDS, FOR DYEING KERATIN FIBRES L'Oréal (FR) 2007-08-22 EP disclosed
CN-1903161-A Composition for simultaneously bleaching and coloring of keratin fibres comprising an anionic or non-ionic dye and an asociative polymer OREAL (FR) 2007-01-31 CN disclosed
CN-1899244-A Agent for simultaneously bleaching and coloring of keratin fibres comprising an anionic or non-ionic dye and an inert organic liquid OREAL (FR) 2007-01-24 CN disclosed
CN-1816317-A Composition comprising at least one substituted 2-[2-(4-amino phenyl)ethenyl]-1-pyridinium derivative, process for treating keratin fibres using it, device and use thereof OREAL (FR) 2006-08-09 CN disclosed
WO-2006063867-A2 SYMMETRICAL DIAZO COMPOUNDS CONTAINING 3-PYRIDINIUM GROUPS AND A NON-CATIONIC LINKER, COMPOSITIONS COMRISISNG THEM, METHOD OF COLOURING, AND DEVICE L'ORÉAL (FR) 2006-06-22 WO disclosed
WO-2006056488-A1 SYMMETRICAL CATIONIC TETRAAZO COMPOUNDS, FOR DYEING KERATIN FIBRES L'OREAL (FR) 2006-06-01 WO disclosed
US-4665083-A ANTIDEPRESSANT, ANTIEPILEPTIC, SPASMOLYTIC, ANTIPARKINSONIC EGIS GYOGYSZERGYAR (HU) 1987-05-12 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-20160106648-A1 COLORING AGENTS AND METHODS OF USE THEREOF MPO, HLA-C, ADH7 KMT2A 1622/4885TSHR 4752/4885TDP1 841/4885

“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.