SCHEMBL30080461

SCHEMBL30080461

C[C@H](N)C(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 4/20 0.46
▸ OPRD1 P41143 4/20 0.46
▸ CAPN1 P07384 4/20 0.45
▸ GRB2 P62993 1/20 0.43
▸ BDKRB2 P30411 4/20 0.41
▸ CTSB P07858 1/20 0.40
▸ RAMP3 O60896 3/20 0.39
▸ CALCR P30988 3/20 0.39
▸ XIAP P98170 1/20 0.38

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
SCHEMBL31259022 0.94 CAPN1 (0.52) OPRM1OPRD1CAPN1GRB2BDKRB2
SCHEMBL29691873 0.93 CAPN1 (0.47) OPRM1OPRD1CAPN1GRB2BDKRB2
SCHEMBL30307615 0.92 OPRM1 (0.46) OPRM1OPRD1CAPN1GRB2BDKRB2
SCHEMBL30167004 0.91 CAPN1 (0.46) OPRM1OPRD1CAPN1GRB2BDKRB2
SCHEMBL29376366 0.91 CAPN1 (0.46) OPRM1OPRD1CAPN1GRB2BDKRB2
SCHEMBL29375301 0.91 CAPN1 (0.46) OPRM1OPRD1CAPN1GRB2BDKRB2
SCHEMBL30139026 0.90 OPRM1 (0.46) OPRM1OPRD1CAPN1GRB2XIAP
SCHEMBL30626180 0.89 OPRM1 (0.51) OPRM1OPRD1CAPN1GRB2BDKRB2
SCHEMBL29397180 0.89 OPRM1 (0.51) OPRM1OPRD1CAPN1GRB2BDKRB2
SCHEMBL29554130 0.89 CAPN1 (0.47) OPRM1OPRD1CAPN1GRB2BDKRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116120425-A GLP-1/GIP receptor dual agonist and application thereof 南京赛诺生物技术有限公司 2023-05-16 — — CN claimed
CN-115594752-A Long-acting double-agonist compound 成都奥达生物科技有限公司(CN) 2023-01-13 — — CN claimed
CN-116120425-A GLP-1/GIP receptor dual agonist and application thereof 南京赛诺生物技术有限公司 2023-05-16 — — CN disclosed
CN-115594753-A Long-acting double-agonist compound 成都奥达生物科技有限公司(CN) 2023-01-13 — — CN disclosed
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