SCHEMBL6445899

SCHEMBL6445899

c1ccc2c(CCO[C@@H]3CCC[C@H]3N3CCOCC3)cccc2c1

nearest known ligand 0.95

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KCNA5 P22460 4/20 0.95
▸ SCN5A Q14524 4/20 0.95
▸ SLC18A2 Q05940 1/20 0.43
▸ SIGMAR1 Q99720 4/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ SLC6A2 P23975 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ ABCB1 P08183 3/20 0.37

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
SCHEMBL3612928 1.00 KCNA5 (0.95) KCNA5SCN5ASLC18A2SIGMAR1L3MBTL1
Hydrochloric Acid SCHEMBL1762334 0.99 KCNA5 (0.93) KCNA5SCN5ASLC18A2SIGMAR1L3MBTL1
Hydrochloric Acid SCHEMBL1762369 0.99 KCNA5 (0.93) KCNA5SCN5ASLC18A2SIGMAR1L3MBTL1
SCHEMBL6807137 0.98 KCNA5 (1.00) KCNA5SCN5ASLC18A2SIGMAR1L3MBTL1
SCHEMBL12391697 0.98 KCNA5 (1.00) KCNA5SCN5ASLC18A2SIGMAR1L3MBTL1
SCHEMBL2624914 0.98 KCNA5 (1.00) KCNA5SCN5ASLC18A2SIGMAR1L3MBTL1
SCHEMBL12203898 0.88 KCNA5 (0.82) KCNA5SCN5ASLC18A2SIGMAR1
SCHEMBL2625053 0.88 KCNA5 (0.82) KCNA5SCN5ASLC18A2SIGMAR1
SCHEMBL12391704 0.82 KCNA5 (1.00) KCNA5SCN5ASLC18A2SIGMAR1
SCHEMBL10207927 0.82 KCNA5 (1.00) KCNA5SCN5ASLC18A2SIGMAR1

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
US-6979685-B1 Cycloalkyl amine compounds and uses thereof CARDIOME PHARMA CORP. (CA) 2005-12-27 — — US claimed
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