SCHEMBL6571129

SCHEMBL6571129

Nc1cn2nccc2nc1O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.40
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
IDO1 P14902 1/20 0.31
PSMB5 P28074 1/20 0.31
NTRK1 P04629 1/20 0.30
IGF1R P08069 1/20 0.30
FGFR1 P11362 1/20 0.30
LTK P29376 1/20 0.30
MAP2K2 P36507 1/20 0.30
MAPK9 P45984 1/20 0.30
RPS6KA3 P51812 1/20 0.30
PRKX P51817 1/20 0.30
PRKCQ Q04759 1/20 0.30
TNK2 Q07912 1/20 0.30
CLK4 Q9HAZ1 1/20 0.30

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
SCHEMBL5741030 0.80 DYRK1A (0.42) DYRK1ANTRK1IGF1RFGFR1LTK
SCHEMBL31465343 0.77 DYRK1A (0.33) DYRK1A
SCHEMBL24253557 0.73 GABRA1 (0.35) DYRK1A
SCHEMBL24253457 0.73 GABRA1 (0.35) DYRK1A
SCHEMBL25892465 0.70 PCSK9 (0.30)
SCHEMBL15261493 0.69 DYRK1A (0.40) DYRK1ANTRK1IGF1RFGFR1LTK
SCHEMBL15690267 0.69 DYRK1A (0.40) DYRK1ANTRK1IGF1RFGFR1LTK
SCHEMBL1440869 0.67 DYRK1A (0.49) DYRK1AIDO1
SCHEMBL24253460 0.66 PCSK9 (0.32) DYRK1A
SCHEMBL25064747 0.66 PRKAB2 (0.34) DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1443890-A1 OXIDATION COLOURING AGENT BASED ON BICYCLIC DEVELOPER COMPONENTS Henkel Kommanditgesellschaft auf Aktien (DE) 2004-08-11 EP claimed
WO-2003041670-A1 OXIDATION COLOURING AGENT BASED ON BICYCLIC DEVELOPER COMPONENTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-05-22 WO claimed
EP-2790660-A1 CATIONIC TETRAHYDROPYRAZOLOPYRIDINES, DYE COMPOSITION COMPRISING SUCH OXIDATION BASES, IMPLEMENTATION PROCESS THEREFOR AND USE THEREOF L'Oréal (FR) 2014-10-22 EP disclosed
WO-2013087933-A1 CATIONIC TETRAHYDROPYRAZOLOPYRIDINES, DYE COMPOSITION COMPRISING SUCH OXIDATION BASES, IMPLEMENTATION PROCESS THEREFOR AND USE THEREOF L'OREAL (FR) 2013-06-20 WO disclosed
WO-2012080285-A2 DYE COMPOSITION COMPRISING A SECONDARY PARA-PHENYLENEDIAMINE OXIDATION BASE AND A 4-AMINOINDOLE COUPLER L'OREAL (FR) 2012-06-21 WO disclosed