SCHEMBL6955449

SCHEMBL6955449

CN1[C@@H]2C[C@@H](N)C[C@H]1CN(c1ccccc1)C2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 1/20 0.42
SLC6A2 P23975 2/20 0.38
SLC6A3 Q01959 2/20 0.38
DPP4 P27487 3/20 0.37
DRD2 P14416 2/20 0.36
SIGMAR1 Q99720 2/20 0.36
MBTD1 Q05BQ5 1/20 0.36
L3MBTL3 Q96JM7 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CHRM3 P20309 3/20 0.36
CHRM2 P08172 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
DRD1 P21728 1/20 0.36
HRH2 P25021 1/20 0.36
ADRA1D P25100 1/20 0.36

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
SCHEMBL6955453 1.00 BPTF (0.42) BPTFSLC6A2SLC6A3DPP4DRD2
SCHEMBL6964059 0.79 MAPK1 (0.46) BPTFL3MBTL1MAPK1
SCHEMBL3134466 0.78 MBTD1 (0.46) BPTFSIGMAR1MBTD1L3MBTL3L3MBTL1
SCHEMBL20858814 0.77 BPTF (0.57) BPTFSLC6A2SLC6A3DPP4SIGMAR1
SCHEMBL17304860 0.77 BPTF (0.50) BPTFSLC6A2SLC6A3DPP4DRD2
SCHEMBL17294901 0.77 BPTF (0.50) BPTFSLC6A2SLC6A3DPP4DRD2
SCHEMBL6990841 0.76 BPTF (0.54) BPTFDPP4DRD2SIGMAR1MBTD1
SCHEMBL6957907 0.75 FUCA1 (0.47) DPP4SIGMAR1OPRM1
SCHEMBL4737149 0.75 FUCA1 (0.47) DPP4SIGMAR1OPRM1
Hydrochloric Acid SCHEMBL30182618 0.74 BPTF (0.52) BPTFDPP4DRD2SIGMAR1MBTD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0550550-A1 3,9-DIAZABICYCLO (3.3.1) NONAN-7-YL DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Beecham Group p.l.c. (GB) 1993-07-14 EP claimed
WO-1992005174-A1 3,9-DIAZABICYCLO (3.3.1) NONAN-7-YL DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 1992-04-02 WO claimed
EP-0550550-B1 3,9-DIAZABICYCLO (3.3.1) NONAN-7-YL DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 2003-07-16 EP disclosed
EP-0550550-A1 3,9-DIAZABICYCLO (3.3.1) NONAN-7-YL DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Beecham Group p.l.c. (GB) 1993-07-14 EP disclosed
WO-1992005174-A1 3,9-DIAZABICYCLO (3.3.1) NONAN-7-YL DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 1992-04-02 WO disclosed