SCHEMBL29693016

SCHEMBL29693016

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 11/20 0.51
▸ OPRK1 P41145 11/20 0.51
▸ NMUR2 Q9GZQ4 6/20 0.49
▸ NMUR1 Q9HB89 6/20 0.49
▸ REN P00797 1/20 0.47
▸ EPHA2 P29317 1/20 0.46
▸ MMP1 P03956 1/20 0.46
▸ MMP3 P08254 1/20 0.46

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
SCHEMBL29693015 0.97 OPRM1 (0.53) OPRM1OPRK1NMUR2NMUR1REN
SCHEMBL29693008 0.92 OPRM1 (0.50) OPRM1OPRK1NMUR2NMUR1EPHA2
SCHEMBL30540072 0.87 OPRM1 (0.50) OPRM1OPRK1NMUR2NMUR1EPHA2
SCHEMBL29561678 0.87 CTRB1 (0.42) OPRM1OPRK1
SCHEMBL30883997 0.84 OPRM1 (0.54) OPRM1OPRK1NMUR2NMUR1
SCHEMBL29693014 0.83 PTPN1 (0.55) —
SCHEMBL29561225 0.83 PRCP (0.46) OPRM1OPRK1NMUR2NMUR1EPHA2
SCHEMBL31467771 0.80 PRCP (0.43) OPRM1OPRK1NMUR2NMUR1EPHA2
SCHEMBL30429187 0.80 CTRB1 (0.51) OPRM1OPRK1
SCHEMBL31588354 0.79 OPRM1 (0.61) OPRM1OPRK1NMUR2NMUR1EPHA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114774395-A High-purity chitinase 3-like protein 1 epitope peptide for liver disease detection and preparation method thereof 亿彤科技发展(福建)有限公司 2022-07-22 — — CN claimed
CN-115015545-B High-sensitivity liver disease detection kit based on chitinase 3-like protein 1 福建亿彤生物科技有限公司 2025-05-09 — — CN disclosed
CN-114836407-B Method for modifying polypeptide by chitinase 3-like protein 1 antigen and carrier protein 亿彤科技发展(福建)有限公司 2023-09-01 — — CN disclosed
CN-114774395-B High-purity chitinase 3-like protein 1 epitope peptide for liver disease detection and preparation method thereof 亿彤科技发展(福建)有限公司 2023-08-22 — — CN disclosed
CN-115015545-A Chitinase 3-like protein 1-based high-sensitivity liver disease detection kit 亿彤科技发展(福建)有限公司 2022-09-06 — — CN disclosed
CN-114836407-A Chitinase 3-like protein 1 antigen and method for modifying polypeptide by carrier protein 亿彤科技发展(福建)有限公司 2022-08-02 — — CN disclosed
CN-114774395-A High-purity chitinase 3-like protein 1 epitope peptide for liver disease detection and preparation method thereof 亿彤科技发展(福建)有限公司 2022-07-22 — — CN disclosed
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