SCHEMBL5283927

SCHEMBL5283927

CCCCCCCCCCCCCCCn1cc(CCCc2ccccc2)nc1Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 4/20 0.60
CYP19A1 P11511 3/20 0.43
HSD11B1 P28845 2/20 0.40
KCNH2 Q12809 3/20 0.40
EEF2K O00418 2/20 0.40
EEF2 P13639 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40
MEN1 O00255 1/20 0.40
PLK4 O00444 1/20 0.40
JAK2 O60674 1/20 0.40
EGFR P00533 1/20 0.40
TYK2 P29597 1/20 0.40
FLT3 P36888 1/20 0.40
BLM P54132 1/20 0.40
KMT2A Q03164 1/20 0.40
ITK Q08881 1/20 0.40
PIM2 Q9P1W9 1/20 0.40

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
SCHEMBL5291087 1.00 TLR8 (0.60) TLR8CYP19A1HSD11B1KCNH2EEF2K
SCHEMBL5307329 1.00 TLR8 (0.60) TLR8CYP19A1HSD11B1KCNH2EEF2K
SCHEMBL5287379 1.00 TLR8 (0.60) TLR8CYP19A1HSD11B1KCNH2EEF2K
SCHEMBL5307031 1.00 TLR8 (0.60) TLR8CYP19A1HSD11B1KCNH2EEF2K
SCHEMBL5815550 1.00 TLR8 (0.60) TLR8CYP19A1HSD11B1KCNH2EEF2K
SCHEMBL5300299 1.00 TLR8 (0.60) TLR8CYP19A1HSD11B1KCNH2EEF2K
SCHEMBL5291339 1.00 TLR8 (0.60) TLR8CYP19A1HSD11B1KCNH2EEF2K
SCHEMBL5301102 1.00 TLR8 (0.60) TLR8CYP19A1HSD11B1KCNH2EEF2K
SCHEMBL5812027 1.00 TLR8 (0.60) TLR8CYP19A1HSD11B1KCNH2EEF2K
SCHEMBL5286098 1.00 TLR8 (0.60) TLR8CYP19A1HSD11B1KCNH2EEF2K

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
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 WO disclosed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 WO disclosed