SCHEMBL9852111

SCHEMBL9852111

NC(Cc1ccc(O)cc1)C(=O)NC(CO)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 1/20 0.61
▸ YARS1 P54577 2/20 0.57
▸ MME P08473 3/20 0.51
▸ OPRD1 P41143 5/20 0.50
▸ OPRM1 P35372 4/20 0.50
▸ ENPEP Q07075 2/20 0.50
▸ ACE P12821 1/20 0.50
▸ CPA1 P15085 1/20 0.50
▸ ACE2 Q9BYF1 1/20 0.50
▸ OPRK1 P41145 1/20 0.50

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
SCHEMBL9852121 1.00 SLC7A5 (0.61) SLC7A5YARS1MMEOPRD1OPRM1
SCHEMBL30622026 1.00 SLC7A5 (0.61) SLC7A5YARS1MMEOPRD1OPRM1
SCHEMBL30839504 0.95 SLC7A5 (0.55) SLC7A5YARS1OPRD1OPRM1ENPEP
SCHEMBL31031588 0.93 SLC7A5 (0.56) SLC7A5YARS1MMEOPRD1OPRM1
SCHEMBL29386283 0.92 OPRD1 (0.58) SLC7A5YARS1MMEOPRD1OPRM1
SCHEMBL31643051 0.92 ENPEP (0.55) SLC7A5YARS1OPRD1OPRM1ENPEP
SCHEMBL30423707 0.92 OPRM1 (0.58) MMEOPRD1OPRM1OPRK1
SCHEMBL30494285 0.91 SLC7A5 (0.51) SLC7A5YARS1OPRD1ENPEP
SCHEMBL1574161 0.91 SLC7A5 (0.65) SLC7A5YARS1MMEOPRD1OPRM1
SCHEMBL1574158 0.91 SLC7A5 (0.65) SLC7A5YARS1MMEOPRD1OPRM1

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
EP-0457314-A1 Nutrient compositions containing peptides CLINTEC NUTRITION COMPANY (US) 1991-11-21 — — EP claimed
WO-2024065882-A1 AMINO ACID-BASED WATER-BASED LIQUID, PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院过程工程研究所 2024-04-04 — — WO disclosed
CN-115400258-B Amino acid-based aqueous liquid, preparation method and application thereof 中国科学院过程工程研究所 2023-11-21 — — CN disclosed
CN-115400258-A Amino acid-based aqueous liquid, and preparation method and application thereof 中国科学院过程工程研究所 2022-11-29 — — CN disclosed
EP-0127108-B1 PROCESS FOR PREPARING POLYPEPTIDES MERCK & CO. INC. (US) 1986-12-30 — — EP disclosed
US-4510083-A POTASSIUM, CESIUM OR RUBIDIUM CARBONATE BUFFER FOR COUPLING OF AMINO ACID N-CARBOXYANHYDRIDE WITH ANOTHER AMINO ACID OR PEPTIDE MERCK & CO., INC. (US) 1985-04-09 — — US disclosed
EP-0127108-A1 Process for preparing polypeptides MERCK & CO. INC. (US) 1984-12-05 — — EP disclosed
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