SCHEMBL3873987

SCHEMBL3873987

CCOc1cc(CN2CCC(N)CC2)cc(OCC)c1-c1ccc(F)cc1

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 20/20 0.68
KCNH2 Q12809 7/20 0.68
SSTR3 P32745 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
SCHEMBL29940195 0.88 SSTR5 (0.66) SSTR5KCNH2SSTR3
Hydrochloric Acid SCHEMBL29940233 0.87 SSTR5 (0.67) SSTR5KCNH2SSTR3
SCHEMBL3876136 0.87 SSTR5 (0.58) SSTR5KCNH2SSTR3
SCHEMBL3872371 0.83 SSTR5 (0.52) SSTR5KCNH2SSTR3
SCHEMBL25900836 0.83 SSTR5 (0.56) SSTR5KCNH2SSTR3
Hydrochloric Acid SCHEMBL25314620 0.82 SSTR5 (0.56) SSTR5KCNH2SSTR3
SCHEMBL3141562 0.81 SSTR5 (0.59) SSTR5KCNH2SSTR3
SCHEMBL3883346 0.80 SSTR5 (0.55) SSTR5KCNH2SSTR3
SCHEMBL4002465 0.79 SSTR5 (0.64) SSTR5KCNH2SSTR3
SCHEMBL1876526 0.79 SSTR5 (0.62) SSTR5KCNH2SSTR3

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
WO-2023125486-A1 SOMATOSTATIN RECEPTOR SUBTYPE 5 ANTAGONISTS, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 中国科学院上海药物研究所 2023-07-06 WO disclosed
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