SCHEMBL29940485

SCHEMBL29940485

CCOc1cc(CN2CCC(COc3ccc(C(=O)O)cc3)CC2)cc(OCC)c1-c1ccc(F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 20/20 1.00
KCNH2 Q12809 5/20 1.00
PTGDR Q13258 1/20 0.59

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
SCHEMBL29939631 0.91 SSTR5 (1.00) SSTR5KCNH2PTGDR
SCHEMBL29939944 0.88 SSTR5 (1.00) SSTR5KCNH2PTGDR
SCHEMBL25900404 0.84 SSTR5 (0.83) SSTR5KCNH2
SCHEMBL29940060 0.83 SSTR5 (1.00) SSTR5KCNH2PTGDR
SCHEMBL29940229 0.83 SSTR5 (1.00) SSTR5KCNH2PTGDR
SCHEMBL29939992 0.83 SSTR5 (1.00) SSTR5KCNH2PTGDR
SCHEMBL29940170 0.82 SSTR5 (1.00) SSTR5KCNH2
SCHEMBL25900395 0.82 SSTR5 (0.71) SSTR5KCNH2PTGDR
SCHEMBL25900535 0.81 SSTR5 (0.70) SSTR5KCNH2PTGDR
Hydrochloric Acid SCHEMBL29940233 0.80 SSTR5 (0.67) SSTR5KCNH2

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
CN-115215787-A Somatostatin receptor 5 antagonists and uses thereof 中国科学院上海药物研究所 2022-10-21 CN disclosed