SCHEMBL6946350

SCHEMBL6946350

CCCC1(CCC)CCC2(CC1)CC(=O)N(C1CN3CCC1CC3)C2=O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.34
HTR1A P08908 1/20 0.34
ADRA2A P08913 1/20 0.34
CHRM1 P11229 1/20 0.34
DRD1 P21728 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
ADRA1A P35348 1/20 0.34
OPRM1 P35372 1/20 0.34
DRD3 P35462 1/20 0.34
SLC6A3 Q01959 1/20 0.34
KCNH2 Q12809 1/20 0.34
CHRM3 P20309 1/20 0.33
HTR3A P46098 2/20 0.32

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
SCHEMBL6946137 0.72 CHRM2 (0.31) CHRM2CHRM3
SCHEMBL6945010 0.68
Hydrochloric Acid SCHEMBL6949704 0.67
SCHEMBL9356154 0.62 CHRM2 (0.44) CHRM2ADRA1ACHRM3
SCHEMBL9355929 0.61 CHRM2 (0.43) CHRM2CHRM1SLC6A2SLC6A4ADRA1A
SCHEMBL7281251 0.58 CHRM2 (0.55) CHRM2HTR1AADRA2ACHRM1DRD1
SCHEMBL7290543 0.58 CHRM2 (0.55) CHRM2HTR1AADRA2ACHRM1DRD1
SCHEMBL1692904 0.58 CHRM2 (0.41) CHRM2HTR1AADRA2ACHRM1DRD1
SCHEMBL29324533 0.56
SCHEMBL6946347 0.55

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0587800-B1 IMMUNOMODULATORY AZASPIRANES ANORMED INC (CA) 2003-04-02 EP disclosed
EP-0654997-A4 COMPOSITIONS OF SUBSTITUTED AZASPIRANES AND METHODS OF TREATING PSORIASIS THEREWITH. SMITHKLINE BEECHAM CORP (US) 1997-09-17 EP disclosed
EP-0771199-A1 METHODS SMITHKLINE BEECHAM CORPORATION (US) 1997-05-07 EP disclosed
US-5591748-A Immunomodulatory azaspiranes SMITHKLINE BEECHAM CORPORATION (US) 1997-01-07 US disclosed
EP-0727993-A4 1996-10-02 EP disclosed
EP-0727993-A1 (NON DESCRIPTIVE)-A METHOD FOR DELAYING HIV INDIVIDUAL AIDS BY ADMINISTRATION OF SUBSTITUTED AZASPIRANE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1996-08-28 EP disclosed
WO-1996003123-A1 METHODS SMITHKLINE BEECHAM CORPORATION (US) 1996-02-08 WO disclosed
US-5455247-A Methods for the treatment of hyperlipidemia using azaspiranes SMITHKLINE BEECHAM CORPORATION (US) 1995-10-03 US disclosed
EP-0654997-A1 COMPOSITIONS OF SUBSTITUTED AZASPIRANES AND METHODS OF TREATING PSORIASIS THEREWITH SMITHKLINE BEECHAM CORPORATION (US) 1995-05-31 EP disclosed
WO-1995003046-A1 A METHOD OF INHIBITING THE PRODUCTION OF HIV SMITHKLINE BEECHAM CORPORATION (US) 1995-02-02 WO disclosed
WO-1995003048-A1 ANTI-HIV AZASPIRANES SMITHKLINE BEECHAM CORPORATION (US) 1995-02-02 WO disclosed
WO-1995003047-A1 HUMAN IMMUNODEFICIENCY VIRUS TREATMENTS SMITHKLINE BEECHAM CORPORATION (US) 1995-02-02 WO disclosed
EP-0609335-A4 METHODS FOR THE TREATMENT OF HYPERLIPIDEMIA USING AZASPIRANES. SMITHKLINE BEECHAM CORP (US) 1994-10-12 EP disclosed
EP-0609335-A1 METHODS FOR THE TREATMENT OF HYPERLIPIDEMIA USING AZASPIRANES SMITHKLINE BEECHAM CORPORATION (US) 1994-08-10 EP disclosed
EP-0587800-A4 IMMUNOMODULATORY AZASPIRANES SMITHKLINE BEECHAM CORP (US) 1994-06-29 EP disclosed
EP-0587800-A1 IMMUNOMODULATORY AZASPIRANES SMITHKLINE BEECHAM CORPORATION (US) 1994-03-23 EP disclosed
WO-1994004151-A1 COMPOSITIONS OF SUBSTITUTED AZASPIRANES AND METHODS OF TREATING PSORIASIS THEREWITH SMITHKLINE BEECHAM CORPORATION (US) 1994-03-03 WO disclosed
WO-1993015735-A1 (NON DESCRIPTIVE)-A METHOD FOR DELAYING HIV INDIVIDUAL AIDS BY ADMINISTRATION OF SUBSTITUTED AZASPIRANE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1993-08-19 WO disclosed
WO-1993007871-A1 METHODS FOR THE TREATMENT OF HYPERLIPIDEMIA USING AZASPIRANES SMITHKLINE BEECHAM CORPORATION (US) 1993-04-29 WO disclosed
WO-1992022294-A1 IMMUNOMODULATORY AZASPIRANES SMITHKLINE BEECHAM CORPORATION (US) 1992-12-23 WO disclosed