SCHEMBL3876291

SCHEMBL3876291

CCOc1cc(CN2CCC(NC(=O)c3cccc(OCCF)c3OCCF)CC2)ccc1-c1ccc(F)cc1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 9/20 0.62
DRD3 P35462 2/20 0.58
CCR3 P51677 5/20 0.51
HTR7 P34969 2/20 0.51
HTR1A P08908 1/20 0.51
DRD2 P14416 1/20 0.51
HTR6 P50406 1/20 0.51
KCNH2 Q12809 2/20 0.51
SLC6A12 P48065 1/20 0.49

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
SCHEMBL2956247 0.85 SSTR5 (0.69) SSTR5CCR3KCNH2
SCHEMBL2965998 0.79 SSTR5 (0.72) SSTR5CCR3KCNH2
SCHEMBL2957516 0.79 SSTR5 (0.75) SSTR5CCR3HTR7KCNH2
SCHEMBL2956220 0.78 SSTR5 (0.66) SSTR5CCR3KCNH2
SCHEMBL2951998 0.77 SSTR5 (0.83) SSTR5CCR3KCNH2
SCHEMBL2954083 0.77 SSTR5 (0.83) SSTR5CCR3KCNH2
SCHEMBL2955285 0.77 SSTR5 (0.69) SSTR5CCR3KCNH2
SCHEMBL2955622 0.77 SSTR5 (1.00) SSTR5KCNH2
SCHEMBL2963832 0.76 SSTR5 (0.73) SSTR5CCR3KCNH2
SCHEMBL2954887 0.76 SSTR5 (0.84) SSTR5CCR3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893603-B1 PIPERIDIN-4-YL-AMIDE DERIVATIVES AND THEIR USE AS SST RECEPTOR SUBTYPE 5 ANTAGONISTS HOFFMANN LA ROCHE (CH) 2009-10-14 EP disclosed