SCHEMBL5299249

SCHEMBL5299249

CCCCCCCc1cc[n+](CCCCCC)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.67
MEN1 O00255 2/20 0.67
MAPT P10636 2/20 0.67
TP53 P04637 2/20 0.67
CYP1A2 P05177 1/20 0.67
CYP2D6 P10635 1/20 0.67
CYP2C9 P11712 1/20 0.67
CYP2C19 P33261 1/20 0.67
HTT P42858 3/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
LMNA P02545 3/20 0.64
KDM4E B2RXH2 2/20 0.64
NPC1 O15118 1/20 0.64
RAB9A P51151 1/20 0.64
ADRA2A P08913 4/20 0.57
ADORA3 P0DMS8 4/20 0.57
SLC6A2 P23975 4/20 0.57
SLC6A4 P31645 4/20 0.57
SLC6A3 Q01959 4/20 0.57
CHRM2 P08172 3/20 0.57

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
SCHEMBL5300250 1.00 KMT2A (0.67) KMT2AMEN1MAPTTP53CYP1A2
SCHEMBL5305804 1.00 KMT2A (0.67) KMT2AMEN1MAPTTP53CYP1A2
SCHEMBL5298755 1.00 KMT2A (0.67) KMT2AMEN1MAPTTP53CYP1A2
SCHEMBL5284938 1.00 KMT2A (0.67) KMT2AMEN1MAPTTP53CYP1A2
SCHEMBL13527286 1.00 KMT2A (0.67) KMT2AMEN1MAPTTP53CYP1A2
SCHEMBL5303764 1.00 KMT2A (0.67) KMT2AMEN1MAPTTP53CYP1A2
SCHEMBL5295568 1.00 KMT2A (0.67) KMT2AMEN1MAPTTP53CYP1A2
SCHEMBL5819831 1.00 KMT2A (0.67) KMT2AMEN1MAPTTP53CYP1A2
SCHEMBL5309579 1.00 KMT2A (0.67) KMT2AMEN1MAPTTP53CYP1A2
SCHEMBL5285972 1.00 KMT2A (0.67) KMT2AMEN1MAPTTP53CYP1A2

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