SCHEMBL30647290

SCHEMBL30647290

C[C@H](NC(=O)CNC(=O)[C@H](COC(C)(C)C)NC(=O)[C@@H](N)COC(C)(C)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 7)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 4/20 0.46
▸ OPRD1 P41143 4/20 0.46
▸ BDKRB2 P30411 2/20 0.41
▸ GRB2 P62993 1/20 0.41
▸ CAPN1 P07384 4/20 0.40
▸ CTSB P07858 1/20 0.38
▸ CMA1 P23946 1/20 0.37

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
SCHEMBL30414346 0.96 GRB2 (0.42) OPRM1OPRD1BDKRB2GRB2CAPN1
SCHEMBL29468766 0.92 GRB2 (0.42) OPRM1OPRD1BDKRB2GRB2CAPN1
SCHEMBL30543480 0.90 GRB2 (0.46) OPRM1OPRD1BDKRB2GRB2
SCHEMBL30626180 0.88 OPRM1 (0.51) OPRM1OPRD1BDKRB2GRB2CAPN1
SCHEMBL29397180 0.88 OPRM1 (0.51) OPRM1OPRD1BDKRB2GRB2CAPN1
SCHEMBL29468832 0.88 GRB2 (0.46) OPRM1OPRD1BDKRB2GRB2
SCHEMBL30543475 0.87 GRB2 (0.41) OPRM1OPRD1BDKRB2GRB2CAPN1
SCHEMBL31337813 0.87 GRB2 (0.44) OPRM1OPRD1BDKRB2GRB2CMA1
SCHEMBL29468889 0.87 GRB2 (0.42) OPRM1OPRD1BDKRB2GRB2CAPN1
SCHEMBL30184771 0.86 OPRM1 (0.47) OPRM1OPRD1BDKRB2GRB2CAPN1

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
US-20230364194-A1 GLP-1R/GCGR Dual Target Agonist Polypeptide Derivative for Treatment of Hepatic Fibrosis Associated with Viral Hepatitis SHENZHEN TURIER BIOTECH CO., LTD. (CN) 2023-11-16 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230364194-A1 GLP-1R/GCGR Dual Target Agonist Polypeptide Derivative for Treatment of Hepatic Fibrosis Associated with Viral Hepatitis GLP1R, GCGR, GIPR OPRM1 3338/4885OPRD1 2819/4885BDKRB2 288/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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