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Sugi Predict / Compounds / SCHEMBL30358170

SCHEMBL30358170

SCHEMBL30358170

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)O

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 5/20 0.72
▸ NPY4R P50391 5/20 0.72
▸ NPY5R Q15761 5/20 0.72
▸ NPY1R P25929 4/20 0.72
▸ GLP1R P43220 9/20 0.70
▸ ECE1 P42892 1/20 0.66
▸ MUS81 Q96NY9 1/20 0.66
▸ CXCR4 P61073 4/20 0.65

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
SCHEMBL30658244 0.94 NPY2R (0.76) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30658333 0.93 NPY2R (0.73) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30658240 0.93 NPY2R (0.74) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30824296 0.93 NPY2R (0.74) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30658289 0.93 NPY2R (0.73) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL29949636 0.93 NPY1R (0.71) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL31182921 0.92 NPY2R (0.76) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30721554 0.92 NPY2R (0.76) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30658277 0.92 NPY2R (0.75) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL29949399 0.92 NPY2R (0.73) NPY2RNPY4RNPY5RNPY1RGLP1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11732279-B2 Method AMD strains for reducing byproduct fumaric acid in fermentation process of L-malic acid and use thereof Nanjing Haohe Biotechnology Co., Ltd. (CN) 2023-08-22 — — US disclosed
US-20230167471-A1 METHOD AMD STRAINS FOR REDUCING BYPRODUCT FUMARIC ACID IN FERMENTATION PROCESS OF L-MALIC ACID AND USE THEREOF Nanjing Haohe Biotechnology Co., Ltd. (CN) 2023-06-01 — — US disclosed
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