SCHEMBL6170468

SCHEMBL6170468

C#C[C@]1(c2ccc(OC)c(OC3CCCC3)c2)CC[C@@H](N)CC1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.73
PDE4A P27815 19/20 0.73
PDE4C Q08493 19/20 0.73
PDE4D Q08499 19/20 0.73

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
SCHEMBL6171409 1.00 PDE4B (0.73) PDE4BPDE4APDE4CPDE4D
SCHEMBL6170471 1.00 PDE4B (0.73) PDE4BPDE4APDE4CPDE4D
SCHEMBL7375528 0.89 PDE4A (0.78) PDE4BPDE4APDE4CPDE4D
SCHEMBL6171292 0.88 PDE4B (0.73) PDE4BPDE4APDE4CPDE4D
SCHEMBL6171289 0.88 PDE4B (0.73) PDE4BPDE4APDE4CPDE4D
SCHEMBL6175086 0.88 PDE4B (0.73) PDE4BPDE4APDE4CPDE4D
SCHEMBL7786858 0.88 PDE4A (0.73) PDE4BPDE4APDE4CPDE4D
SCHEMBL7411778 0.88 PDE4A (0.73) PDE4BPDE4APDE4CPDE4D
SCHEMBL7793256 0.88 PDE4A (0.73) PDE4BPDE4APDE4CPDE4D
SCHEMBL7869861 0.86 PDE4B (0.73) PDE4BPDE4APDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0794774-B1 4,4-(DISUBSTITUTED)CYCLOHEXAN-1-OLS MONOMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2005-10-12 EP disclosed
US-5977122-A 4,4-(disubstituted)cyclohexan-1-ols monomers and related compounds SMITHKLINE BEECHAM CORPORATION (US) 1999-11-02 US disclosed
US-5891883-A 4,4-(disubstituted)cyclohexan-1-ols monomers and related compounds SMITHKLINE BEECHAM CORPORATION (US) 1999-04-06 US disclosed
EP-0828493-A4 4.4-(DISUBSTITUTED)CYCLOHEXAN-1-OLS-MONOMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORP (US) 1998-09-02 EP disclosed
EP-0828493-A1 4.4-(DISUBSTITUTED)CYCLOHEXAN-1-OLS-MONOMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1998-03-18 EP disclosed
WO-1996038150-A1 4.4-(DISUBSTITUTED)CYCLOHEXAN-1-OLS-MONOMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1996-12-05 WO disclosed
WO-1996019988-A1 4,4-(DISUBSTITUTED)CYCLOHEXAN-1-OLS MONOMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1996-07-04 WO disclosed