SCHEMBL6963845

SCHEMBL6963845

CCCN1CC2CC(=O)CC(C1)N2C

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.50
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
DRD2 P14416 4/20 0.35
SLC6A4 P31645 1/20 0.35
GBA1 P04062 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.31
DRD1 P21728 1/20 0.31
DRD4 P21917 1/20 0.31
DRD5 P21918 1/20 0.31
DRD3 P35462 1/20 0.31

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
SCHEMBL6962132 0.86 MAPK1 (0.52) MAPK1MEN1KMT2A
SCHEMBL6961682 0.78 MAPK1 (0.48) MAPK1MEN1KMT2ADRD2
SCHEMBL20049300 0.76 GBA1 (0.39) DRD2GBA1SMN1; SMN2DRD1DRD4
SCHEMBL6952003 0.76 MAPK1 (0.60) MAPK1MEN1KMT2A
SCHEMBL12593647 0.75
SCHEMBL6964168 0.74 ACHE (0.47) MEN1KMT2AGBA1
SCHEMBL6950217 0.73 MAPK1 (0.52) MAPK1MEN1KMT2A
SCHEMBL6959368 0.72 FUCA1 (0.47) DRD2SMN1; SMN2DRD4DRD3
SCHEMBL2326162 0.72 GBA1 (0.39) DRD2SLC6A4GBA1DRD1DRD4
SCHEMBL5415021 0.71 MAPK1 (0.48) MAPK1MEN1KMT2A

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