SCHEMBL5299079

SCHEMBL5299079

CCCCCCCCCCCCn1cc[n+](C)c1CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.46
RAB9A P51151 7/20 0.46
HTT P42858 6/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
MAPK1 P28482 3/20 0.46
NPSR1 Q6W5P4 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
HSP90AA1 P07900 3/20 0.46
MAPT P10636 2/20 0.46
APAF1 O14727 1/20 0.46
PLA2G1B P04054 1/20 0.46
ATG4B Q9Y4P1 1/20 0.46
EEF2K O00418 2/20 0.43
EEF2 P13639 2/20 0.43
PLK4 O00444 1/20 0.43
JAK2 O60674 1/20 0.43
EGFR P00533 1/20 0.43
TYK2 P29597 1/20 0.43
FLT3 P36888 1/20 0.43

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
SCHEMBL5815613 1.00 NPC1 (0.46) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL5299942 1.00 NPC1 (0.46) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL5290076 1.00 NPC1 (0.46) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL5298484 1.00 NPC1 (0.46) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL5322247 1.00 NPC1 (0.46) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL5290433 1.00 NPC1 (0.46) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL5285261 1.00 NPC1 (0.46) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL5289050 1.00 NPC1 (0.46) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL5307267 1.00 NPC1 (0.46) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL5289248 1.00 NPC1 (0.46) NPC1RAB9AHTTSMN1; SMN2MAPK1

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