SCHEMBL4591507

SCHEMBL4591507

CCCCCOc1ccc(CN2CCC(NC(=O)c3cncc(C)c3)CC2)cc1OCC

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 20/20 0.79
SSTR1 P30872 1/20 0.77
HRH1 P35367 1/20 0.77
KCNH2 Q12809 1/20 0.68

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
SCHEMBL2955294 0.91 SSTR5 (0.83) SSTR5SSTR1HRH1KCNH2
SCHEMBL2960567 0.89 SSTR5 (1.00) SSTR5SSTR1HRH1KCNH2
SCHEMBL2962919 0.89 SSTR5 (0.86) SSTR5SSTR1HRH1KCNH2
SCHEMBL2957292 0.87 SSTR5 (0.78) SSTR5SSTR1HRH1KCNH2
SCHEMBL2958524 0.87 SSTR5 (0.83) SSTR5SSTR1HRH1KCNH2
SCHEMBL2956224 0.87 SSTR5 (0.83) SSTR5SSTR1HRH1KCNH2
SCHEMBL2956249 0.87 SSTR5 (1.00) SSTR5SSTR1HRH1KCNH2
SCHEMBL2961777 0.86 SSTR5 (0.86) SSTR5SSTR1HRH1KCNH2
SCHEMBL2955312 0.85 SSTR5 (0.85) SSTR5SSTR1HRH1KCNH2
SCHEMBL2962030 0.85 SSTR5 (0.85) SSTR5SSTR1HRH1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893603-A1 PIPERIDIN-4-YL-AMIDE DERIVATIVES AND THEIR USE AS SST RECEPTOR SUBTYPE 5 ANTAGONISTS F. Hoffmann-La Roche AG (CH) 2008-03-05 EP disclosed
WO-2006128803-A1 PIPERIDIN-4-YL-AMIDE DERIVATIVES AND THEIR USE AS SST RECEPTOR SUBTYPE 5 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-12-07 WO disclosed