SCHEMBL19001491

SCHEMBL19001491

NCCCCCC[n+]1ccc(/C=C/c2ccc(N(CCO)CCO)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 6/20 0.50
KDM2A Q9Y2K7 6/20 0.50
CHRM2 P08172 2/20 0.48
CHRM4 P08173 2/20 0.48
CHRM5 P08912 2/20 0.48
CHRM1 P11229 2/20 0.48
CHRM3 P20309 2/20 0.48
INSR P06213 2/20 0.38
MEN1 O00255 3/20 0.35
MAPT P10636 3/20 0.35
KMT2A Q03164 3/20 0.35
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
ALPG P10696 1/20 0.35
THRB P10828 1/20 0.35
GFER P55789 1/20 0.35
CHKA P35790 2/20 0.34

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 SCHEMBL18986638 0.97 KDM4A (0.48) KDM4AKDM2ACHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL18986758 0.97 KDM4A (0.48) KDM4AKDM2ACHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL18986639 0.97 KDM4A (0.48) KDM4AKDM2ACHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL18986759 0.97 KDM4A (0.48) KDM4AKDM2ACHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL18986818 0.92 CHRM2 (0.48) KDM4AKDM2ACHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL18986819 0.92 CHRM2 (0.48) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL19003845 0.90 KDM4A (0.54) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL19003868 0.90 KDM4A (0.54) KDM4AKDM2ACHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL18986708 0.89 KDM4A (0.52) KDM4AKDM2ACHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL18986825 0.89 KDM4A (0.52) KDM4AKDM2ACHRM2CHRM4CHRM5

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
US-10959930-B2 Process for dyeing keratin fibres using at least one particular triarylmethane dye and at least one fluorescent dye L'OREAL (FR) 2021-03-30 US disclosed
US-20200276097-A1 PROCESS FOR DYEING KERATIN FIBRES USING AT LEAST ONE PARTICULAR TRIARYLMETHANE DYE AND AT LEAST ONE FLUORESCENT DYE L'OREAL (FR) 2020-09-03 US disclosed
WO-2018115156-A1 PROCESS FOR DYEING KERATIN FIBRES USING AT LEAST ONE PARTICULAR TRIARYLMETHANE DYE AND AT LEAST ONE FLUORESCENT DYE L'OREAL (FR) 2018-06-28 WO disclosed
WO-2017103045-A1 COMPOSITION FOR DYEING KERATIN FIBRES, COMPRISING A STYRYL OR NAPHTHYLAMIDE DIRECT DYE BEARING AN AMINOALKYL FUNCTION, DYEING PROCESS AND DYE L'OREAL (FR) 2017-06-22 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-20200276097-A1 PROCESS FOR DYEING KERATIN FIBRES USING AT LEAST ONE PARTICULAR TRIARYLMETHANE DYE AND AT LEAST ONE FLUORESCENT DYE KRT18, CUTA, GLA KDM4A 389/4885KDM2A 356/4885CHRM2 2058/4885
US-10959930-B2 Process for dyeing keratin fibres using at least one particular triarylmethane dye and at least one fluorescent dye KRT18, CUTA, GLA KDM4A 389/4885KDM2A 356/4885CHRM2 2058/4885

“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.