SCHEMBL29532282

SCHEMBL29532282

NCCCC[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 5/20 0.52
▸ NTSR2 O95665 8/20 0.52
▸ NTSR1 P30989 7/20 0.52
▸ SORT1 Q99523 4/20 0.52
▸ OPRD1 P41143 4/20 0.52
▸ SLC6A2 P23975 1/20 0.48

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
SCHEMBL29380576 0.95 OPRM1 (0.59) OPRM1NTSR2NTSR1SORT1OPRD1
SCHEMBL29379358 0.94 OPRD1 (0.52) OPRM1NTSR2NTSR1SORT1OPRD1
SCHEMBL30116347 0.94 OPRD1 (0.57) OPRM1NTSR2NTSR1SORT1OPRD1
SCHEMBL29380132 0.94 OPRD1 (0.52) OPRM1NTSR2NTSR1SORT1OPRD1
SCHEMBL31683331 0.94 OPRD1 (0.52) OPRM1NTSR2NTSR1SORT1OPRD1
SCHEMBL29380423 0.92 OPRD1 (0.55) OPRM1NTSR2NTSR1SORT1OPRD1
SCHEMBL29765222 0.92 OPRM1 (0.62) OPRM1NTSR2NTSR1SORT1OPRD1
SCHEMBL29392625 0.91 OPRD1 (0.54) OPRM1NTSR2NTSR1SORT1OPRD1
SCHEMBL30629451 0.91 OPRD1 (0.59) OPRM1NTSR2NTSR1SORT1OPRD1
SCHEMBL30631183 0.91 OPRD1 (0.60) OPRM1NTSR2NTSR1SORT1OPRD1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022164222-A2 PHARMACEUTICAL COMPOSITION COMPRISING GIP DERIVATIVE OR LONG-ACTING CONJUGATE THEREOF FOR PREVENTING OR TREATING PULMONARY DISEASE 한미약품 주식회사 2022-08-04 — — WO disclosed
WO-2022080986-A1 GLP-1/GIP DUAL AGONIST, LONG-ACTING CONJUGATE THEREOF, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 한미약품 주식회사 2022-04-21 — — WO disclosed
WO-2022080985-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING LUPUS-RELATED DISEASES COMPRISING GIP DERIVATIVE OR LONG-ACTING CONJUGATE THEREOF 한미약품 주식회사 2022-04-21 — — WO disclosed
WO-2022080984-A1 GIP DERIVATIVE, LONG-ACTING CONJUGATE THEREOF, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 한미약품 주식회사 2022-04-21 — — WO disclosed
WO-2022080989-A1 PHARMACEUTICAL COMPOSITION COMPRISING GLUCAGON/GLP-1/GIP TRIPLE AGONIST OR LONG-ACTING CONJUGATE THEREOF FOR PREVENTING OR TREATING LUPUS-RELATED DISEASES 한미약품 주식회사 2022-04-21 — — WO disclosed
WO-2022080987-A1 PHARMACEUTICAL COMPOSITION COMPRISING GLUCAGON/GLP-1/GIP TRIPLE AGONIST OR LONG-ACTING CONJUGATE THEREOF FOR PREVENTING OR TREATING VASCULITIS 한미약품 주식회사 2022-04-21 — — WO disclosed
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