SCHEMBL7808357

SCHEMBL7808357

CN1C2CCC1CC(N)(Cc1ccccc1)C2

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.52
MAOB P27338 7/20 0.52
OPRM1 P35372 2/20 0.51
OPRL1 P41146 2/20 0.51
KDM1A O60341 4/20 0.44
SLC6A4 P31645 3/20 0.43
SLC6A3 Q01959 3/20 0.43
SLC6A2 P23975 2/20 0.43
HRH3 Q9Y5N1 1/20 0.43

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
SCHEMBL4076260 0.78 SLC6A4 (0.41) OPRM1OPRL1SLC6A4SLC6A3SLC6A2
SCHEMBL23950409 0.73 MAOA (0.61) MAOAMAOBOPRM1OPRL1KDM1A
SCHEMBL4591914 0.72 CHRM2 (0.45)
SCHEMBL8267929 0.70 MAOA (0.68) MAOAMAOBOPRM1OPRL1KDM1A
SCHEMBL3651250 0.70 MAOA (0.61) MAOAMAOBOPRM1OPRL1KDM1A
SCHEMBL1318340 0.69 MAOA (1.00) MAOAMAOBOPRM1OPRL1KDM1A
SCHEMBL8267931 0.68 MAOA (0.58) MAOAMAOBHRH3
Hydrochloric Acid SCHEMBL1318464 0.68 MAOA (0.95) MAOAMAOBOPRL1KDM1A
SCHEMBL7121075 0.67 SLC6A3 (0.53) MAOAMAOBOPRM1OPRL1SLC6A4
SCHEMBL1022483 0.67 OPRM1 (0.54) OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0690055-B1 Stereoselective process for making endo-tropanamine and like compounds LILLY CO ELI (US) 2001-11-14 EP disclosed
US-5625065-A Stereoselective process for making endo-tropanamine and like compounds ELI LILLY AND COMPANY (US) 1997-04-29 US disclosed
EP-0690055-A1 Stereoselective process for making endo-tropanamine and like compounds ELI LILLY AND COMPANY (US) 1996-01-03 EP disclosed