SCHEMBL13645967

SCHEMBL13645967

CN(CCN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1)c1ccc(/C=C/c2cc[n+](C)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.68
KMT2A Q03164 5/20 0.68
ALDH1A1 P00352 4/20 0.68
MAPT P10636 4/20 0.68
SMN1; SMN2 Q16637 3/20 0.68
HTT P42858 2/20 0.68
LMNA P02545 1/20 0.68
ALPG P10696 1/20 0.68
THRB P10828 1/20 0.68
GFER P55789 1/20 0.68
NPSR1 Q6W5P4 1/20 0.68
CHAT P28329 5/20 0.52
RAB9A P51151 5/20 0.52
KDM4E B2RXH2 2/20 0.52
HPGD P15428 1/20 0.52
CYP2C19 P33261 1/20 0.52
GAA P10253 1/20 0.49
CASP1 P29466 1/20 0.49
BRCA1 P38398 1/20 0.49
CASP7 P55210 1/20 0.49

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
SCHEMBL13645972 0.91 MEN1 (0.62) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL1827814 0.90 MEN1 (0.60) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL1827812 0.90 MEN1 (0.60) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL13043730 0.90 MEN1 (0.60) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
Iodide SCHEMBL7032870 0.89 MEN1 (0.63) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
Iodide SCHEMBL27637940 0.89 MEN1 (0.63) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL10104040 0.89 MEN1 (0.58) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
Iodide SCHEMBL7032875 0.89 MEN1 (0.63) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL14509505 0.87 ALDH1A1 (0.66) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL14146585 0.87 MEN1 (0.57) MEN1KMT2AALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2018848-B1 Hair composition comprising at least one fluorescent dye and at least one alkali hydroxide agent and method of simultaneous styling, dyeing and/or lightening. OREAL (FR) 2013-01-09 EP disclosed
US-7601180-B2 Use for the dyeing with lightening effect of keratin substances of a composition comprising a fluorescent cyanine dye L'OREAL S.A. (FR) 2009-10-13 US disclosed
US-20090049621-A1 USE FOR THE DYEING WITH LIGHTENING EFFECT OF KERATIN SUBSTANCES OF A COMPOSITION COMPRISING A FLUORESCENT CYANINE DYE L'OREAL S.A. (FR) 2009-02-26 US disclosed
EP-2018848-A2 Hair composition comprising at least one fluorescent dye and at least one alkali hydroxide agent and method of simultaneous styling, dyeing and/or lightening. L'Oreal (FR) 2009-01-28 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-20090049621-A1 USE FOR THE DYEING WITH LIGHTENING EFFECT OF KERATIN SUBSTANCES OF A COMPOSITION COMPRISING A FLUORESCENT CYANINE DYE KRT18, S100A4, S100P MEN1 2692/4885KMT2A 1544/4885ALDH1A1 1895/4885

“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.