SCHEMBL4592104

SCHEMBL4592104

CCOc1cc(CN(C(=O)c2cc(OC)cc(OCC(=O)O)c2)C2CCNCC2)cc(OCC)c1-c1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 11/20 0.42
KCNH2 Q12809 2/20 0.42
TACR1 P25103 5/20 0.41
HTR2A P28223 1/20 0.38

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
SCHEMBL4591473 0.92 TACR1 (0.41) SSTR5KCNH2TACR1HTR2A
SCHEMBL4629774 0.88 SSTR5 (0.40) SSTR5KCNH2TACR1HTR2A
SCHEMBL4591860 0.86 TACR1 (0.45) KCNH2TACR1
SCHEMBL4591464 0.81 REN (0.38) KCNH2TACR1HTR2A
SCHEMBL4591930 0.80 POLB (0.42) SSTR5KCNH2TACR1HTR2A
SCHEMBL4591887 0.78 TACR1 (0.45) KCNH2TACR1HTR2A
SCHEMBL4591455 0.78 TACR1 (0.37) KCNH2TACR1HTR2A
SCHEMBL4591939 0.77 SLC6A4 (0.38) KCNH2TACR1HTR2A
SCHEMBL4591832 0.77 HTR2A (0.40) KCNH2TACR1HTR2A
SCHEMBL4591515 0.77 REN (0.39) KCNH2TACR1HTR2A

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 4 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 claimed
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 claimed
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