SCHEMBL1979095

SCHEMBL1979095

CC(N)Oc1cc(N)ccc1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.43
GAA P10253 4/20 0.43
MAPT P10636 7/20 0.38
HTT P42858 3/20 0.38
TSHR P16473 2/20 0.38
MAPK1 P28482 2/20 0.38
TDP1 Q9NUW8 4/20 0.38
CYP3A4 P08684 3/20 0.38
HSD17B10 Q99714 2/20 0.38
CASP1 P29466 2/20 0.37
ALOX15 P16050 1/20 0.35
KDM4E B2RXH2 5/20 0.35
MEN1 O00255 4/20 0.35
POLB P06746 4/20 0.35
KMT2A Q03164 4/20 0.35
USP2 O75604 3/20 0.35
TP53 P04637 1/20 0.35
CASP7 P55210 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL7519140 0.85 ALDH1A1 (0.44) ALDH1A1GAAMAPTHTTTSHR
SCHEMBL3732045 0.83 ALDH1A1 (0.47) ALDH1A1GAAMAPTHTTTSHR
SCHEMBL214546 0.82 ALDH1A1 (0.42) ALDH1A1GAAMAPTHTTTSHR
Hydrochloric Acid SCHEMBL5792316 0.80 ALDH1A1 (0.44) ALDH1A1GAAMAPTHTTTSHR
SCHEMBL111528 0.79 ALDH1A1 (0.40) ALDH1A1GAAMAPTHTTTSHR
SCHEMBL24620479 0.77 GAA (0.38) ALDH1A1GAAMAPTHTTTSHR
SCHEMBL28282441 0.76 ALDH1A1 (0.41) ALDH1A1GAAMAPTHTTTSHR
SCHEMBL11225859 0.76 ALDH1A1 (0.53) ALDH1A1GAAMAPTHTTTSHR
SCHEMBL2471333 0.74 HTT (0.65) ALDH1A1GAAMAPTHTTTSHR
SCHEMBL22471043 0.73 ALDH1A1 (0.34) ALDH1A1GAAMAPTHTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2509951-A1 NOVEL CATIONIC AMINOPYRIDINES, DYE COMPOSITION COMPRISING A CATIONIC AMINOPYRIDINE, PROCESSES THEREFOR AND USES THEREOF L'Oréal (FR) 2012-10-17 EP disclosed
EP-2509977-A1 NOVEL CATIONIC 4-AMINOINDOLES, DYE COMPOSITION COMPRISING A CATIONIC 4-AMINOINDOLE, PROCESSES THEREFOR AND USES THEREOF L'Oréal (FR) 2012-10-17 EP disclosed
WO-2011069898-A1 NOVEL CATIONIC AMINOPYRIDINES, DYE COMPOSITION COMPRISING A CATIONIC AMINOPYRIDINE, PROCESSES THEREFOR AND USES THEREOF L'OREAL (FR) 2011-06-16 WO disclosed
WO-2011069952-A1 NOVEL CATIONIC 4-AMINOINDOLES, DYE COMPOSITION COMPRISING A CATIONIC 4-AMINOINDOLE, PROCESSES THEREFOR AND USES THEREOF L'OREAL (FR) 2011-06-16 WO disclosed
EP-1868687-A1 AQUEOUS COMPOSITION COMPRISING HYDROGEN PEROXIDE AND INERT PARTICLES L'Oréal (FR) 2007-12-26 EP disclosed
WO-2006106000-A1 AQUEOUS COMPOSITION COMPRISING HYDROGEN PEROXIDE AND INERT PARTICLES L'ORÉAL (FR) 2006-10-12 WO disclosed