SCHEMBL3633276

SCHEMBL3633276

CCOc1cc(CN2CCC3(CC2)CCN(c2ccccc2)C3)cc(OCC)c1-c1ccc(F)cc1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 20/20 0.60
KCNH2 Q12809 6/20 0.60
PTGDR Q13258 2/20 0.60

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
SCHEMBL25317829 0.84 SSTR5 (0.77) SSTR5KCNH2PTGDR
SCHEMBL10111350 0.84 SSTR5 (0.83) SSTR5KCNH2PTGDR
SCHEMBL30482791 0.83 SSTR5 (0.72) SSTR5KCNH2PTGDR
Trifluoroacetic Acid SCHEMBL30482775 0.81 SSTR5 (0.79) SSTR5KCNH2PTGDR
SCHEMBL25900961 0.81 SSTR5 (0.65) SSTR5KCNH2PTGDR
SCHEMBL2419405 0.81 SSTR5 (0.61) SSTR5KCNH2PTGDR
SCHEMBL25314023 0.79 SSTR5 (0.73) SSTR5KCNH2PTGDR
SCHEMBL10111383 0.78 SSTR5 (0.70) SSTR5KCNH2PTGDR
SCHEMBL10111398 0.78 SSTR5 (0.70) SSTR5KCNH2PTGDR
SCHEMBL25314865 0.78 SSTR5 (0.72) SSTR5KCNH2PTGDR

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-2152710-A2 4,4-DISUBSTITUTED PIPERIDINE DERIVATIVES F. Hoffmann-Roche AG (CH) 2010-02-17 EP claimed
WO-2008145524-A2 4,4-DISUBSTITUTED PIPERIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2008-12-04 WO claimed