SCHEMBL4713248

SCHEMBL4713248

CCCCCCc1ccccc1C12CNCC1C2

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.41
SLC6A4 P31645 3/20 0.41
SLC6A3 Q01959 3/20 0.41
KCNH2 Q12809 2/20 0.41
DRD2 P14416 2/20 0.41
DRD3 P35462 2/20 0.41
LIPG Q9Y5X9 1/20 0.40

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
Hydrochloric Acid SCHEMBL11076402 0.68 SLC6A2 (0.56) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL9699968 0.67 LIPG (0.69) KCNH2LIPG
SCHEMBL10980560 0.67 LIPG (0.69) KCNH2LIPG
SCHEMBL2511612 0.67 LIPG (0.69) KCNH2LIPG
SCHEMBL18496530 0.67 LIPG (0.69) KCNH2LIPG
SCHEMBL1343771 0.67 LIPG (0.69) KCNH2LIPG
SCHEMBL15809821 0.67 LIPG (0.69) KCNH2LIPG
SCHEMBL7534048 0.67 LIPG (0.69) KCNH2LIPG
SCHEMBL6679764 0.67 LIPG (0.69) KCNH2LIPG
SCHEMBL10755599 0.67 LIPG (0.69) KCNH2LIPG

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
EP-1904059-A2 METHOD FOR TREATING NERVOUS SYSTEM DISORDERS AND CONDITIONS Wyeth a Corporation of the State of Delaware (US) 2008-04-02 EP disclosed
WO-2007013936-A2 METHOD FOR TREATING NERVOUS SYSTEM DISORDERS AND CONDITIONS WYETH (US) 2007-02-01 WO disclosed