SCHEMBL28777524

SCHEMBL28777524

CC(C)(C)NC(=O)O[C@H]1CCN(c2c(C=O)cnc(Cl)c2Br)C1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CCNE1 P24864 12/20 0.33
▸ CDK2 P24941 12/20 0.33
▸ SMO Q99835 1/20 0.33
▸ GSK3B P49841 4/20 0.32
▸ HRH3 Q9Y5N1 2/20 0.31
▸ CNR2 P34972 1/20 0.31
▸ ACACB O00763 3/20 0.31
▸ OPRK1 P41145 1/20 0.31

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
SCHEMBL28777662 0.85 HRH3 (0.34) HRH3ACACBOPRK1
SCHEMBL28777659 0.85 HRH3 (0.34) HRH3ACACBOPRK1
SCHEMBL28777529 0.78 JAK3 (0.49) —
SCHEMBL29653516 0.78 JAK3 (0.49) —
SCHEMBL28777527 0.78 JAK3 (0.49) —
SCHEMBL28613367 0.75 ACACB (0.41) CCNE1CDK2ACACB
SCHEMBL22976542 0.74 AURKA (0.37) OPRK1
SCHEMBL22976543 0.74 AURKA (0.37) OPRK1
SCHEMBL2425205 0.73 PIM1 (0.38) —
SCHEMBL2425207 0.73 PIM1 (0.38) —

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
CN-117043149-A Crystalline forms of somatostatin modulators 克林提克斯医药股份有限公司 2023-11-10 — — CN disclosed
CN-114585614-A Non-peptide somatostatin type 5 receptor agonists and uses thereof 克林提克斯医药股份有限公司 2022-06-03 — — CN disclosed
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