SCHEMBL28777659

SCHEMBL28777659

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

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 12/20 0.34
▸ OPRK1 P41145 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ ACACB O00763 2/20 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 1.00 HRH3 (0.34) HRH3OPRK1CYP3A4ACACB
SCHEMBL28777524 0.85 CCNE1 (0.33) HRH3OPRK1ACACB
SCHEMBL28777695 0.82 SSTR2 (0.35) HRH3
SCHEMBL28777696 0.82 SSTR2 (0.35) HRH3
SCHEMBL28944317 0.78 ACACB (0.43) HRH3OPRK1ACACB
SCHEMBL22976542 0.78 AURKA (0.37) OPRK1
SCHEMBL22976543 0.78 AURKA (0.37) OPRK1
SCHEMBL28944316 0.78 ACACB (0.43) HRH3OPRK1ACACB
SCHEMBL29653516 0.74 JAK3 (0.49) —
SCHEMBL28777527 0.74 JAK3 (0.49) —

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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