SCHEMBL13745385

SCHEMBL13745385

CCn1c(NCCc2cc[n+](C)cc2)c(N)c(=O)n1CC

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 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
SCHEMBL13745857 0.86 FDPS (0.32) ALDH1A1GAAMAPTHPGDHTT
SCHEMBL13745315 0.77
SCHEMBL13746321 0.74 MEN1 (0.38) MAPTHTT
SCHEMBL944239 0.74
SCHEMBL13745771 0.70
SCHEMBL13745682 0.70
SCHEMBL13745856 0.68
SCHEMBL13746323 0.65
SCHEMBL13745668 0.64 FDPS (0.30)
SCHEMBL13746232 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009098257-A1 COMPOSITION FOR DYEING KERATIN FIBRES COMPRISING AT LEAST ONE CATIONIC DIAMINO-N,N-DIHYDROPYRAZOLONE DERIVATIVE L'OREAL (FR) 2009-08-13 WO disclosed