SCHEMBL6744524

SCHEMBL6744524

CC[N+]1(C)CCN(c2ccc(N)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA10 Q9GZZ6 6/20 0.56
CHRNA9 Q9UGM1 6/20 0.56
MAPT P10636 5/20 0.56
GFER P55789 4/20 0.56
KDM4E B2RXH2 3/20 0.56
GAA P10253 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
RAD52 P43351 1/20 0.56
ALDH1A1 P00352 4/20 0.52
KMT2A Q03164 3/20 0.52
ADRA2C P18825 1/20 0.52
PTK2B Q14289 1/20 0.52
ESR2 Q92731 1/20 0.52
CHRNA7 P36544 6/20 0.51
ALOX15 P16050 2/20 0.48
HTT P42858 2/20 0.48
HSD17B10 Q99714 2/20 0.48
MEN1 O00255 2/20 0.48
POLB P06746 2/20 0.48
NPC1 O15118 1/20 0.48

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 SCHEMBL5350248 0.98 CHRNA10 (0.55) CHRNA10CHRNA9MAPTGFERKDM4E
SCHEMBL10105152 0.83 CHRNA7 (0.72) CHRNA10CHRNA9SMN1; SMN2KMT2ACHRNA7
SCHEMBL5351218 0.81 MAPT (0.47) CHRNA10CHRNA9MAPTGFERKDM4E
SCHEMBL6743986 0.81 ALOX15 (0.64) MAPTGFERKDM4EGAASMN1; SMN2
Hydrochloric Acid SCHEMBL5349721 0.80 MAPT (0.46) CHRNA10CHRNA9MAPTGFERKDM4E
Hydrochloric Acid SCHEMBL5350629 0.79 ALOX15 (0.62) MAPTGFERKDM4EGAASMN1; SMN2
SCHEMBL6742074 0.79 GFER (0.50) CHRNA10CHRNA9MAPTGFERKDM4E
Hydrochloric Acid SCHEMBL5358867 0.79 MAPT (0.46) CHRNA10CHRNA9MAPTGFERKDM4E
SCHEMBL6745520 0.79 GAA (0.61) CHRNA10CHRNA9MAPTKDM4EGAA
SCHEMBL6748728 0.79 MAPT (0.45) CHRNA10CHRNA9MAPTGFERKDM4E

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-1462091-A1 Composition for dyeing of keratinic fibers comprising a cationic derivative of p-phenylenediamine substituted by a diazacyclohexane or a diazacyloheptane L'OREAL (FR) 2004-09-29 EP claimed
US-7186277-B2 Composition for dyeing keratin fibres, comprising a cationic para-phenylenediamine derivative substituted with a diazacyclohexane or diazacycloheptane ring L'OREAL SA (FR) 2007-03-06 US disclosed