SCHEMBL6950217

SCHEMBL6950217

CN1C2CC(=O)CC1CN(CC1CCCCC1)C2

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.52
CHRM5 P08912 2/20 0.41
ADRA2C P18825 1/20 0.41
ACHE P22303 1/20 0.41
OPRM1 P35372 7/20 0.40
OPRL1 P41146 7/20 0.40
OPRK1 P41145 5/20 0.39
OPRD1 P41143 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM1 P11229 1/20 0.37
SIGMAR1 Q99720 2/20 0.36
TRPC5 Q9UL62 1/20 0.35

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
SCHEMBL6952559 0.78 CHRM5 (0.42) CHRM5ADRA2CACHEOPRM1OPRL1
SCHEMBL6962132 0.74 MAPK1 (0.52) MAPK1MEN1KMT2A
SCHEMBL16128230 0.73 CHRM5 (0.65) MAPK1CHRM5ADRA2CACHEOPRM1
SCHEMBL6963845 0.73 MAPK1 (0.50) MAPK1MEN1KMT2A
SCHEMBL6961682 0.72 MAPK1 (0.48) MAPK1MEN1KMT2A
SCHEMBL6584171 0.72 ACHE (0.50) CHRM5ADRA2CACHEOPRM1OPRL1
SCHEMBL13908059 0.69 MAPK1 (1.00) MAPK1CHRM5MEN1KMT2ACHRM2
SCHEMBL551145 0.69 MAPK1 (1.00) MAPK1CHRM5MEN1KMT2ACHRM2
SCHEMBL6952003 0.69 MAPK1 (0.60) MAPK1MEN1KMT2A
SCHEMBL6018054 0.69 MAPK1 (0.81) 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