SCHEMBL5294205

SCHEMBL5294205

CCc1cc[n+](C(CC)c2ccccc2)cc1CC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
POLB P06746 1/20 0.35
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
TP53 P04637 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33
CCR5 P51681 1/20 0.33
CHAT P28329 1/20 0.33
HTR2A P28223 2/20 0.32
HRH1 P35367 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL5302810 0.84 PPARG (0.36) LMNAPOLBHTR2AHRH1TDP1
SCHEMBL5295338 0.81 HTR2A (0.36) LMNAOPRL1HTR2AALDH1A1SIGMAR1
SCHEMBL5304678 0.80 HTR2A (0.41) HTR2A
SCHEMBL5295767 0.79 HTR2A (0.43) HTR2A
SCHEMBL5286065 0.79 HTR2A (0.43) HTR2A
SCHEMBL5295594 0.79 HTR2A (0.43) HTR2A
SCHEMBL5304257 0.79 HTR2A (0.43) HTR2A
SCHEMBL5814692 0.79 HTR2A (0.43) HTR2A
SCHEMBL5305851 0.79 HTR2A (0.43) HTR2A
SCHEMBL5296234 0.79 HTR2A (0.43) HTR2A

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