SCHEMBL29940202

SCHEMBL29940202

CCOc1cc(CN2CCC(F)(COc3ccc(C(=O)O)cc3)CC2)ccc1C

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 19/20 0.71
KCNH2 Q12809 2/20 0.71
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
Trifluoroacetic Acid SCHEMBL29940329 0.86 SSTR5 (0.69) SSTR5KCNH2
SCHEMBL29939719 0.85 SSTR5 (0.72) SSTR5KCNH2
SCHEMBL29940229 0.83 SSTR5 (1.00) SSTR5KCNH2
Trifluoroacetic Acid SCHEMBL29940320 0.79 SSTR5 (0.79) SSTR5KCNH2
SCHEMBL29940236 0.77 SSTR5 (0.59) SSTR5KCNH2
SCHEMBL29939992 0.74 SSTR5 (1.00) SSTR5KCNH2
SCHEMBL29940060 0.74 SSTR5 (1.00) SSTR5KCNH2
SCHEMBL2413559 0.72 SSTR5 (0.66) SSTR5
SCHEMBL25315721 0.72 SSTR5 (0.58) SSTR5KCNH2
SCHEMBL31501401 0.72 SSTR5 (0.58) 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