SCHEMBL3835511

SCHEMBL3835511

Cc1ccc2c(N)c(NCC[N+]3(C)CCOCC3)nn2c1C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.32
SCN9A Q15858 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 SCHEMBL3851757 0.98 CNR1 (0.32) CNR1SCN9A
SCHEMBL3842227 0.90
SCHEMBL3837774 0.89
Hydrochloric Acid SCHEMBL3860501 0.88
Hydrochloric Acid SCHEMBL3852504 0.87
SCHEMBL3841228 0.81
Hydrochloric Acid SCHEMBL3851977 0.79
SCHEMBL3835781 0.78 CTDSP1 (0.38) CNR1
SCHEMBL3835579 0.77 CNR1 (0.33) CNR1SCN9A
SCHEMBL16081509 0.77 MEN1 (0.36)

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-1792903-B1 Composition for the dyeing of keratin fibres comprising at least one cationic 3-amino-pyrazolopyridine derivative OREAL (FR) 2009-10-14 EP disclosed
EP-1792903-A1 Composition for the dyeing of keratin fibres comprising at least one cationic 3-amino-pyrazolopyridine derivative L'OREAL (FR) 2007-06-06 EP disclosed