SCHEMBL11190854

SCHEMBL11190854

CN1CC2CCCC[C@H]2[C@@H](c2ccccc2)C1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.42
SLC6A2 P23975 5/20 0.41
SLC6A4 P31645 5/20 0.41
SLC6A3 Q01959 5/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HRH3 Q9Y5N1 1/20 0.40
CYP2D6 P10635 3/20 0.40
KCNH2 Q12809 1/20 0.40
KDM1A O60341 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
OPRL1 P41146 1/20 0.39

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
SCHEMBL11190856 1.00 CHRNA7 (0.42) CHRNA7SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL8900770 0.87 MEN1 (0.44) CHRNA7SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL8967406 0.83 CHRNA7 (0.42) CHRNA7SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL8541939 0.83 CHRNA7 (0.42) CHRNA7SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL8546489 0.83 CHRNA7 (0.42) CHRNA7SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL8541943 0.83 CHRNA7 (0.42) CHRNA7SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL9090924 0.79 CHRNA7 (0.44) CHRNA7SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL14011291 0.78 MEN1 (0.51) CHRNA7SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL14011287 0.78 MEN1 (0.51) CHRNA7SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL8967316 0.75 SLC6A2 (0.42) CHRNA7SLC6A2SLC6A4SLC6A3KDM1A

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-4419517-A ANALGESICS E. I. DU PONT DE NEMOURS & CO. (US) 1983-12-06 US disclosed