SCHEMBL8104839

SCHEMBL8104839

CNc1ccc(N(C)CC[n+]2ccn(C)c2)cc1N

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.31

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 SCHEMBL7718852 0.99 PRKCI (0.31) PRKCI
Hydrochloric Acid SCHEMBL7713857 0.98 PRKCI (0.30) PRKCI
SCHEMBL6151869 0.81 MAPT (0.39)
Water SCHEMBL7664154 0.79 MAPT (0.37)
SCHEMBL7863664 0.76
Hydrochloric Acid SCHEMBL7718851 0.74 PRKCI (0.30) PRKCI
Hydrochloric Acid SCHEMBL7713856 0.73
SCHEMBL7875691 0.71
SCHEMBL7875689 0.70 PRKCI (0.36) PRKCI
SCHEMBL2930835 0.69 ALDH1A1 (0.50)

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
EP-1022271-A1 Cationic monobenzenic dyes, their use for the oxydative dyeing of keratinic fibres ,dye compositions and dyeing processes L'OREAL (FR) 2000-07-26 EP claimed
EP-1022271-A1 Cationic monobenzenic dyes, their use for the oxydative dyeing of keratinic fibres ,dye compositions and dyeing processes L'OREAL (FR) 2000-07-26 EP disclosed