SCHEMBL6308287

SCHEMBL6308287

COc1ccc(N=Nc2n(C)cc[n+]2C)cc1.[O-][Cl+2]([O-])[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.41
RAB9A P51151 6/20 0.41
MAPK1 P28482 5/20 0.41
NPC1 O15118 4/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
KDM4E B2RXH2 3/20 0.41
PKM P14618 1/20 0.41
PTGS2 P35354 1/20 0.40
LMNA P02545 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
GAA P10253 1/20 0.33
GFER P55789 1/20 0.33
GSK3B P49841 1/20 0.33
MAPK9 P45984 1/20 0.32

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
SCHEMBL6308285 1.00 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1
SCHEMBL20323029 0.94 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1
SCHEMBL1131569 0.94 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1
SCHEMBL1131570 0.94 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1
Iodide SCHEMBL18063119 0.93 MAPT (0.40) MAPTRAB9AMAPK1NPC1MEN1
Hydrochloric Acid SCHEMBL338803 0.93 MAPT (0.40) MAPTRAB9AMAPK1NPC1MEN1
Hydrochloric Acid SCHEMBL338804 0.93 MAPT (0.40) MAPTRAB9AMAPK1NPC1MEN1
Iodide SCHEMBL18063120 0.93 MAPT (0.40) MAPTRAB9AMAPK1NPC1MEN1
Perchlorate SCHEMBL5860330 0.92 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1
Perchlorate SCHEMBL5860332 0.92 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6893471-B2 Dyeing composition for keratinous fibers comprising a particular dicationic diazo dye L'OREAL S.A. (FR) 2005-05-17 US disclosed
CN-1541086-A Dyeing compson. for kerationous fibres comprising particular dicationic diazo dye �ź㴫 2004-10-27 CN disclosed
US-20040143911-A1 Dyeing composition for keratinous fibres comprising a particular dicationic diazo dye L'OREAL S.A. (FR) 2004-07-29 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-20040143911-A1 Dyeing composition for keratinous fibres comprising a particular dicationic diazo dye DSG1, KRT18, DSC1 MAPT 1196/4885RAB9A 4236/4885MAPK1 2042/4885

“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.