SCHEMBL1131920

SCHEMBL1131920

CN(C)c1ccc(/N=N\c2ccccn2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 1.00
MAOB P27338 3/20 1.00
ALDH1A1 P00352 1/20 0.61
TSHR P16473 1/20 0.61
MAPK1 P28482 1/20 0.61
HSD17B10 Q99714 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
KCNH2 Q12809 12/20 0.60
RIOK2 Q9BVS4 1/20 0.52
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
ALPL P05186 1/20 0.50
ALPI P09923 1/20 0.50
ALPG P10696 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL407009 1.00 MAOA (1.00) MAOAMAOBALDH1A1TSHRMAPK1
SCHEMBL407010 1.00 MAOA (1.00) MAOAMAOBALDH1A1TSHRMAPK1
SCHEMBL29351256 1.00 MAOA (1.00) MAOAMAOBALDH1A1TSHRMAPK1
Bromide SCHEMBL27643162 0.98 MAOA (0.97) MAOAMAOBALDH1A1TSHRMAPK1
SCHEMBL20865430 0.80 MAOA (0.71) MAOAMAOBALDH1A1TDP1KCNH2
SCHEMBL670018 0.79 MAOA (1.00) MAOAMAOBALDH1A1TDP1KCNH2
SCHEMBL670019 0.79 MAOA (1.00) MAOAMAOBALDH1A1TDP1KCNH2
SCHEMBL2561900 0.77 MAOA (0.96) MAOAMAOBALDH1A1TDP1KCNH2
SCHEMBL2561898 0.77 MAOA (0.96) MAOAMAOBALDH1A1TDP1KCNH2
SCHEMBL4961652 0.77 MAOA (0.62) MAOAMAOBKCNH2RIOK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2336248-A1 Dying composition comprising a particular disulfide dye and process of dying keratinous fibres with this dye L'Oréal (FR) 2011-06-22 EP disclosed
EP-2333018-A1 Dying composition comprising a particular disulfide dye and process of dying keratinous fibres with this dye L'Oréal (FR) 2011-06-15 EP disclosed
EP-2330160-A1 Dying composition comprising a particular disulfide dye and process of dying keratinous fibres with this dye L'Oréal (FR) 2011-06-08 EP disclosed
EP-1647580-B1 Dying composition comprising a particular disulfide dye and process of dying keratinous fibres with this dye. OREAL (FR) 2011-02-16 EP disclosed
US-7488354-B2 Dyeing composition comprising at least one disulphide dye and method of dyeing human keratin fibers using this dye L'OREAL S.A. (FR) 2009-02-10 US disclosed
US-20060080791-A1 Dyeing composition comprising at least one disulphide dye and method of dyeing human keratin fibers using this dye L'OREAL S.A. (FR) 2006-04-20 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

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-20060080791-A1 Dyeing composition comprising at least one disulphide dye and method of dyeing human keratin fibers using this dye KRT18, DSG1, DSC1 MAOA 2442/4885MAOB 2550/4885ALDH1A1 1195/4885

“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.