SCHEMBL16997443

SCHEMBL16997443

CCCCCN(C)c1ccc(/C=C/C2=[N+](C)c3ccccc3C2(C)C)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.55
APP P05067 3/20 0.55
VDR P11473 5/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
LMNA P02545 3/20 0.41
HTT P42858 2/20 0.41
MMP14 P50281 1/20 0.41
ALDH1A1 P00352 2/20 0.40
THRB P10828 2/20 0.40
RECQL P46063 2/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
KDM4A O75164 4/20 0.38
KDM2A Q9Y2K7 4/20 0.38
INSR P06213 3/20 0.37
NPC1 O15118 1/20 0.36
S1PR4 O95977 1/20 0.36
POLB P06746 1/20 0.36
ALPG P10696 1/20 0.36
PKM P14618 1/20 0.36

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
SCHEMBL18102259 0.89 MAPT (0.61) MAPTAPPVDRMEN1KMT2A
SCHEMBL13069889 0.87 MAPT (0.57) MAPTAPPVDRMEN1KMT2A
SCHEMBL13043721 0.86 MAPT (0.54) MAPTAPPVDRMEN1KMT2A
SCHEMBL13043718 0.86 MAPT (0.57) MAPTAPPVDRMEN1KMT2A
Hydrochloric Acid SCHEMBL2323911 0.85 MAPT (0.56) MAPTAPPVDRMEN1KMT2A
SCHEMBL13908712 0.85 MAPT (0.53) MAPTAPPVDRMEN1KMT2A
Hydrochloric Acid SCHEMBL2401411 0.85 MAPT (0.56) MAPTAPPVDRMEN1KMT2A
Hydrochloric Acid SCHEMBL29363133 0.85 MAPT (0.56) MAPTAPPVDRMEN1KMT2A
SCHEMBL6128371 0.83 MAPT (0.51) MAPTAPPVDRMEN1KMT2A
SCHEMBL14612426 0.83 MAPT (0.51) MAPTAPPVDRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9730876-B2 Process for dyeing keratin fibres comprising a dye-pigment, a photoactive compound and a light source L'OREAL (FR) 2017-08-15 US disclosed
US-20150224041-A1 PROCESS FOR DYEING KERATIN FIBRES COMPRISING A DYE-PIGMENT, A PHOTOACTIVE COMPOUND AND A LIGHT SOURCE L'OREAL (FR) 2015-08-13 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-20150224041-A1 PROCESS FOR DYEING KERATIN FIBRES COMPRISING A DYE-PIGMENT, A PHOTOACTIVE COMPOUND AND A LIGHT SOURCE KRT18, IK, CUTA MAPT 236/4885APP 335/4885VDR 2295/4885

“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.