SCHEMBL3135069

SCHEMBL3135069

CCOc1cc(CN2CCC(n3c(C)nc4cc(OC(=O)O)ccc43)CC2)cc(OCC)c1-c1ccc(F)cc1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 19/20 0.57
KCNH2 Q12809 6/20 0.56
SSTR3 P32745 1/20 0.50
ALDH1A1 P00352 1/20 0.48

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
SCHEMBL3128606 0.90 ALDH1A1 (0.47) SSTR5KCNH2ALDH1A1
SCHEMBL3081916 0.89 SSTR5 (0.62) SSTR5KCNH2
SCHEMBL3137920 0.87 ALDH1A1 (0.46) SSTR5ALDH1A1
SCHEMBL3128617 0.87 SSTR5 (0.47) SSTR5KCNH2ALDH1A1
SCHEMBL3137260 0.87 USP2 (0.44) SSTR5KCNH2ALDH1A1
SCHEMBL3133924 0.87 USP2 (0.44) SSTR5KCNH2ALDH1A1
SCHEMBL3133541 0.86 SSTR5 (0.50) SSTR5KCNH2ALDH1A1
SCHEMBL3128281 0.85 USP2 (0.47) KCNH2ALDH1A1
SCHEMBL3134311 0.84 SSTR5 (0.43) SSTR5KCNH2ALDH1A1
SCHEMBL3128667 0.84 SSTR5 (0.48) SSTR5KCNH2ALDH1A1

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-2142528-B1 1-(1-BENZYLPIPERIDIN-4-YL)BENZIMIDAZ0LE -5-CARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF DIABETES MELLITUS HOFFMANN LA ROCHE (CH) 2010-07-07 EP claimed