SCHEMBL29973263

SCHEMBL29973263

CCCC[C@H](NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNPAT O15228 2/20 0.65
SIRT6 Q8N6T7 1/20 0.46
SIRT1 Q96EB6 1/20 0.46
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
ALOX15 P16050 1/20 0.43
NFKB1 P19838 1/20 0.43
PTGS2 P35354 1/20 0.43
THPO P40225 1/20 0.43
RECQL P46063 1/20 0.43
BLM P54132 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.42
ENPEP Q07075 6/20 0.41
SIRT5 Q9NXA8 1/20 0.41
MME P08473 1/20 0.41
NOD1 Q9Y239 1/20 0.41
EPHX2 P34913 2/20 0.40
HDAC2 Q92769 1/20 0.39

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
SCHEMBL29696978 0.94 GNPAT (0.63) GNPATSIRT6SIRT1KDM4EMAPT
SCHEMBL31615759 0.90 GNPAT (0.59) GNPATSIRT6SIRT1KDM4EMAPT
SCHEMBL31615037 0.90 GNPAT (0.59) GNPATSIRT6SIRT1KDM4EMAPT
SCHEMBL31615880 0.90 GNPAT (0.59) GNPATSIRT6SIRT1KDM4EMAPT
SCHEMBL12729522 0.86 GNPAT (0.63) GNPATKDM4EMAPTTHRBALOX15
SCHEMBL30152075 0.86 GNPAT (0.59) GNPATSIRT6SIRT1SIRT5MME
SCHEMBL29833617 0.86 GNPAT (0.51) GNPATENPEPMMENOD1EPHX2
SCHEMBL22862417 0.85 GNPAT (0.69) GNPATKDM4EMAPTTHRBALOX15
SCHEMBL31688028 0.83 GNPAT (0.52) GNPATSIRT6SIRT1KDM4EMAPT
SCHEMBL137690 0.83 SMN1; SMN2 (0.55) GNPATSIRT6SIRT1KDM4EMAPT

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-116143881-A Preparation method of bumenopeptide 深圳市健元医药科技有限公司 2023-05-23 CN claimed
CN-113621022-B Synthesis method of cyclic peptide 甘肃瑞德林生物有限公司 2024-05-28 CN disclosed
CN-117843715-A Liquid phase synthesis method of melanoputan-II 浙江工业大学 2024-04-09 CN disclosed
CN-116640182-A Transdermal delivery system for polypeptides and related compounds 泰飞尔生物医药(苏州)有限公司 2023-08-25 CN disclosed
CN-116143881-A Preparation method of bumenopeptide 深圳市健元医药科技有限公司 2023-05-23 CN disclosed
CN-116143881-A Preparation method of bumenopeptide 深圳市健元医药科技有限公司 2023-05-23 CN disclosed
EP-4067370-A1 HIGH PENETRATION PRODRUG COMPOSITIONS OF PEPTIDES AND PEPTIDE RELATED COMPOUNDS Yu, Chongxi (US) 2022-10-05 EP disclosed