SCHEMBL29706282

SCHEMBL29706282

NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 5/20 0.42
▸ DPP8 Q6V1X1 2/20 0.42
▸ FAP Q12884 1/20 0.42
▸ DPP9 Q86TI2 1/20 0.42
▸ DPP7 Q9UHL4 1/20 0.42
▸ PLG P00747 3/20 0.40
▸ PLAT P00750 2/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ GRB2 P62993 1/20 0.39
▸ ITGB1 P05556 1/20 0.36
▸ ITGA4 P13612 1/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ ANPEP P15144 1/20 0.36
▸ F2 P00734 1/20 0.36
▸ F10 P00742 1/20 0.36
▸ PRSS1 P07477 1/20 0.36

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
SCHEMBL7899891 0.98 GRB2 (0.41) DPP4DPP8FAPDPP9DPP7
SCHEMBL7899895 0.98 GRB2 (0.41) DPP4DPP8FAPDPP9DPP7
Hydrochloric Acid SCHEMBL7899918 0.97 GRB2 (0.41) DPP4DPP8FAPDPP9DPP7
Hydrochloric Acid SCHEMBL7899915 0.97 GRB2 (0.41) DPP4DPP8FAPDPP9DPP7
SCHEMBL29630697 0.96 GRB2 (0.44) DPP4DPP8FAPDPP9DPP7
SCHEMBL29591671 0.96 GRB2 (0.44) DPP4DPP8FAPDPP9DPP7
SCHEMBL29438447 0.91 DPP4 (0.43) DPP4DPP8FAPDPP9DPP7
SCHEMBL30574235 0.89 DPP4 (0.42) DPP4DPP8FAPDPP9DPP7
SCHEMBL15481300 0.87 DPP4 (0.42) DPP4DPP8FAPDPP9DPP7
SCHEMBL30081105 0.86 DPP4 (0.36) DPP4DPP8FAPDPP9DPP7

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
WO-2022186290-A1 DIPEPTIDYL PEPTIDASE-IV INHIBITOR 森永乳業株式会社 2022-09-09 — — WO claimed
CN-116615436-A Disulfide bond-containing polypeptide with serine protease activity inhibiting function, hybrid peptide derived from disulfide bond-containing polypeptide and application of disulfide bond-containing polypeptide 中国医学科学院药物研究所 2023-08-18 — — CN disclosed
WO-2022186290-A1 DIPEPTIDYL PEPTIDASE-IV INHIBITOR 森永乳業株式会社 2022-09-09 — — WO disclosed
WO-2022186290-A1 DIPEPTIDYL PEPTIDASE-IV INHIBITOR 森永乳業株式会社 2022-09-09 — — WO disclosed
CN-114573686-A Polypeptide containing disulfide bond and having serine protease activity inhibition function and application thereof 中国医学科学院药物研究所 2022-06-03 — — CN disclosed
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