SCHEMBL5413624

SCHEMBL5413624

CCn1ncc(N)c1NCCCCCO

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
JAK3 P52333 1/20 0.34
KCNH3 Q9ULD8 2/20 0.33
TLR8 Q9NR97 2/20 0.33
TLR7 Q9NYK1 2/20 0.33
GSTM2 P28161 1/20 0.33
ALDH1A1 P00352 3/20 0.33
PDE5A O76074 2/20 0.32
KMT2A Q03164 3/20 0.32
LMNA P02545 2/20 0.32
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
FLT3 P36888 2/20 0.32
TYRO3 Q06418 2/20 0.32
MERTK Q12866 2/20 0.32
GAS6 Q14393 2/20 0.32
PDE4B Q07343 1/20 0.32
MEN1 O00255 1/20 0.32
GMNN O75496 1/20 0.32

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
SCHEMBL5399963 0.89 JAK2 (0.35) JAK2JAK1JAK3KCNH3TLR8
SCHEMBL5405380 0.88 HRH4 (0.34) JAK3ALDH1A1KMT2AMEN1CYP2D6
SCHEMBL5439335 0.87 JAK2 (0.34) JAK2JAK1JAK3KCNH3GSTM2
SCHEMBL14357571 0.82 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5409869 0.82 NUDT1 (0.34) TLR8TLR7SMN1; SMN2FLT3TYRO3
SCHEMBL5406970 0.81 XDH (0.34) TLR8TLR7ALDH1A1PDE5AKMT2A
SCHEMBL5406786 0.80 JAK2 (0.32) JAK2JAK1JAK3PDE5ACDK1
SCHEMBL5417504 0.80 NUDT1 (0.36) CYP1A2NUDT1CDK1CDK2
SCHEMBL5433234 0.79 MERTK (0.36) TLR8TLR7ALDH1A1MERTK
SCHEMBL5405663 0.79 MERTK (0.34) MERTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7300469-B2 Diaminopyrazole compounds and the use thereof in the oxidation dyeing of keratinous fibres L'OREAL, SA (FR) 2007-11-27 US claimed
US-7300469-B2 Diaminopyrazole compounds and the use thereof in the oxidation dyeing of keratinous fibres L'OREAL, SA (FR) 2007-11-27 US disclosed
US-7300469-B2 Diaminopyrazole compounds and the use thereof in the oxidation dyeing of keratinous fibres L'OREAL, SA (FR) 2007-11-27 US disclosed
US-7300469-B2 Diaminopyrazole compounds and the use thereof in the oxidation dyeing of keratinous fibres L'OREAL, SA (FR) 2007-11-27 US disclosed