SCHEMBL13645969

SCHEMBL13645969

CC[n+]1ccccc1/C=C/c1ccc(N(C)CCCCN(C)c2ccc(/C=C/c3cccc[n+]3CC)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.73
KMT2A Q03164 10/20 0.73
RAB9A P51151 7/20 0.73
NPC1 O15118 5/20 0.73
HTT P42858 5/20 0.73
MAPT P10636 5/20 0.73
ALDH1A1 P00352 4/20 0.73
SMN1; SMN2 Q16637 4/20 0.73
STAT3 P40763 1/20 0.73
KDM4A O75164 4/20 0.58
KDM2A Q9Y2K7 4/20 0.58
APOBEC3A P31941 2/20 0.52
APOBEC3G Q9HC16 2/20 0.52
GFER P55789 2/20 0.52
KDM4E B2RXH2 2/20 0.44
LMNA P02545 4/20 0.43
NPSR1 Q6W5P4 4/20 0.43
POLB P06746 3/20 0.43
THRB P10828 3/20 0.43
PPARG P37231 2/20 0.43

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
Hydrochloric Acid SCHEMBL3866926 0.99 MEN1 (0.71) MEN1KMT2ARAB9ANPC1HTT
Hydrochloric Acid SCHEMBL3866923 0.99 MEN1 (0.71) MEN1KMT2ARAB9ANPC1HTT
Hydrochloric Acid SCHEMBL3866925 0.99 MEN1 (0.71) MEN1KMT2ARAB9ANPC1HTT
SCHEMBL10104174 0.93 MEN1 (0.64) MEN1KMT2ARAB9ANPC1HTT
SCHEMBL10104170 0.91 MEN1 (0.65) MEN1KMT2ARAB9ANPC1HTT
SCHEMBL12657105 0.90 MEN1 (0.64) MEN1KMT2ARAB9ANPC1HTT
SCHEMBL10313112 0.89 MEN1 (0.62) MEN1KMT2ARAB9ANPC1HTT
SCHEMBL10104042 0.88 MEN1 (0.68) MEN1KMT2ARAB9ANPC1HTT
SCHEMBL10104097 0.87 MEN1 (0.60) MEN1KMT2ARAB9ANPC1HTT
SCHEMBL12657238 0.86 MEN1 (0.69) MEN1KMT2ARAB9ANPC1HTT

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-B2 Hair composition comprising at least one fluorescent dye and at least one alkali hydroxide agent and method of simultaneous styling, dyeing and/or lightening. ORÉAL L (FR) 2016-08-31 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 1544/4885RAB9A 4477/4885

“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.