SCHEMBL8290937

SCHEMBL8290937

COc1ccccc1CC(O)(c1ccccc1)[C@@H]1CN(Cc2ccccc2)CCO1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.60
DRD4 P21917 11/20 0.53
DRD2 P14416 1/20 0.44
DRD3 P35462 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 1/20 0.44
SIGMAR1 Q99720 1/20 0.44

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
SCHEMBL5038410 1.00 SLC6A2 (0.60) SLC6A2DRD4DRD2DRD3MEN1
SCHEMBL14595287 1.00 SLC6A2 (0.60) SLC6A2DRD4DRD2DRD3MEN1
SCHEMBL14202986 1.00 SLC6A2 (0.60) SLC6A2DRD4DRD2DRD3MEN1
SCHEMBL14203018 0.91 SLC6A2 (0.51) SLC6A2DRD4SIGMAR1
SCHEMBL5043878 0.91 SLC6A2 (0.51) SLC6A2DRD4SIGMAR1
SCHEMBL14203001 0.91 SLC6A2 (0.51) SLC6A2DRD4SIGMAR1
SCHEMBL5038423 0.91 SLC6A2 (0.51) SLC6A2DRD4SIGMAR1
SCHEMBL8292652 0.91 SLC6A2 (0.51) SLC6A2DRD4SIGMAR1
SCHEMBL14595291 0.91 SLC6A2 (0.51) SLC6A2DRD4SIGMAR1
SCHEMBL5671331 0.91 DRD4 (0.50) SLC6A2DRD4SIGMAR1

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-2005020975-A2 TREATMENT OF LEARNING DISABILITIES AND MOTOR SKILLS DISORDER WITH NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2005-03-10 WO disclosed