Sugi Predict

Sugi Predict / Compounds / SCHEMBL30358165

SCHEMBL30358165

SCHEMBL30358165

CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N(C)[C@H](C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)(C)C

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 3/20 0.61
▸ TFPI P10646 6/20 0.58
▸ MAOB P27338 1/20 0.58
▸ KDM5A P29375 1/20 0.58
▸ KDM1B Q8NB78 1/20 0.58
▸ NPY2R P49146 7/20 0.56
▸ NPY4R P50391 7/20 0.56
▸ NPY5R Q15761 7/20 0.56
▸ NPY1R P25929 5/20 0.56
▸ EPHA2 P29317 2/20 0.56

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
SCHEMBL31182850 0.89 TFPI (0.63) KDM1ATFPIMAOBKDM5AKDM1B
SCHEMBL31182597 0.87 KEAP1 (0.63) KDM1ATFPINPY2RNPY4RNPY5R
SCHEMBL31031455 0.87 KDM1A (0.65) KDM1ATFPIMAOBKDM5AKDM1B
SCHEMBL29625796 0.87 KDM1A (0.66) KDM1ATFPIMAOBKDM5AKDM1B
SCHEMBL29625797 0.87 TFPI (0.66) KDM1ATFPIMAOBKDM5AKDM1B
SCHEMBL30495741 0.87 KDM1A (0.70) KDM1ATFPIMAOBKDM5AKDM1B
SCHEMBL29652676 0.87 TFPI (0.61) KDM1ATFPIMAOBKDM5AKDM1B
SCHEMBL30576992 0.86 KDM1A (0.64) KDM1ATFPIMAOBKDM5AKDM1B
SCHEMBL31031546 0.86 KDM1A (0.67) KDM1ATFPIMAOBKDM5AKDM1B
SCHEMBL30432704 0.86 NPY2R (0.68) KDM1ATFPIMAOBKDM5AKDM1B

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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