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Sugi Predict / Compounds / SCHEMBL29558121

SCHEMBL29558121

SCHEMBL29558121

CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 7/20 0.65
▸ NTSR1 P30989 6/20 0.64
▸ NTSR2 O95665 3/20 0.62
▸ OPRM1 P35372 1/20 0.62
▸ SORT1 Q99523 2/20 0.61
▸ NPY1R P25929 1/20 0.60

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
SCHEMBL30844080 0.92 CALCR (0.67) OPRD1NTSR1
SCHEMBL29479848 0.92 F2 (0.63) NTSR1NPY1R
SCHEMBL29884239 0.91 CALCR (0.69) NPY1R
SCHEMBL30648484 0.90 CALCR (0.62) NTSR1NPY1R
SCHEMBL31683307 0.90 NPY2R (0.62) OPRD1NTSR1NTSR2SORT1NPY1R
SCHEMBL29679500 0.90 CALCR (0.64) NTSR1NTSR2SORT1NPY1R
SCHEMBL30435444 0.90 OPRD1 (0.67) OPRD1OPRM1NPY1R
SCHEMBL31182911 0.89 CALCR (0.65) OPRD1OPRM1NPY1R
SCHEMBL30567778 0.89 CALCR (0.66) OPRD1OPRM1NPY1R
SCHEMBL31683333 0.88 CALCR (0.60) OPRD1OPRM1NPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203145-A1 ANTI-GDF15 NEUTRALIZING MONOCLONAL ANTIBODY AND USE THEREOF NUAGE (SHAANXI) MEDICAL AND TECHNOLOGY COMPANY LTD (CN) 2023-06-29 — — US claimed
CN-111393526-B anti-GDF 15 neutralizing monoclonal antibody and application thereof 中国人民解放军第四军医大学 2022-04-12 — — CN claimed
CN-114560938-B Neutralizing monoclonal antibody against GDF15 and application thereof 中国人民解放军第四军医大学 2023-05-23 — — CN disclosed
CN-114560938-A anti-GDF 15 neutralizing monoclonal antibody and application thereof 中国人民解放军第四军医大学 2022-05-31 — — CN disclosed
CN-111393526-B anti-GDF 15 neutralizing monoclonal antibody and application thereof 中国人民解放军第四军医大学 2022-04-12 — — CN disclosed
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