SCHEMBL8194037

SCHEMBL8194037

Clc1cccc(Cl)c1CCOC1CCCCC1N1CCC2(C1)OCCO2

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KCNA5 P22460 9/20 0.47
▸ SCN5A Q14524 9/20 0.47
▸ L3MBTL3 Q96JM7 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ KCND2 Q9NZV8 5/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ CYP2C19 P33261 2/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SIGMAR1 Q99720 1/20 0.31
▸ OPRK1 P41145 1/20 0.31
▸ HTT P42858 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
SCHEMBL12204055 0.81 KCNA5 (0.69) KCNA5SCN5ASLC6A4ALDH1A1TSHR
SCHEMBL1762462 0.81 KCNA5 (0.69) KCNA5SCN5ASLC6A4ALDH1A1TSHR
SCHEMBL2625038 0.81 KCNA5 (0.69) KCNA5SCN5ASLC6A4ALDH1A1TSHR
SCHEMBL1762344 0.81 KCNA5 (0.69) KCNA5SCN5ASLC6A4ALDH1A1TSHR
SCHEMBL12810299 0.77 KCNA5 (0.46) KCNA5SCN5ASLC6A4KCND2KCNH2
SCHEMBL14288312 0.76 SLC6A4 (0.62) KCNA5SCN5AL3MBTL1SLC6A4KCND2
SCHEMBL2624893 0.76 SLC6A4 (0.62) KCNA5SCN5AL3MBTL1SLC6A4KCND2
Hydrochloric Acid SCHEMBL2479603 0.75 KCNA5 (0.62) KCNA5SCN5AL3MBTL1SLC6A4KCND2
SCHEMBL4018701 0.74 SLC6A4 (0.57) KCNA5SCN5ASLC6A4KCND2KCNH2
SCHEMBL7871969 0.74 KCNA5 (0.46) KCNA5SCN5ASLC6A4KCND2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000047547-A2 CYCLOALKYL AMINE COMPOUNDS AND USES THEREOF NORTRAN PHARMACEUTICALS INC. (CA) 2000-08-17 — — WO disclosed
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