SCHEMBL30138997

SCHEMBL30138997

CC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 7/20 0.42
▸ DPP4 P27487 6/20 0.40
▸ FAP Q12884 3/20 0.40
▸ REN P00797 3/20 0.40
▸ DPP8 Q6V1X1 2/20 0.40
▸ DPP9 Q86TI2 2/20 0.40
▸ DPP7 Q9UHL4 2/20 0.40
▸ PREP P48147 2/20 0.40
▸ XIAP P98170 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.38
▸ F2 P00734 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ LTA4H P09960 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ PEPD P12955 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ HTR2A P28223 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ HRH1 P35367 1/20 0.38

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
SCHEMBL38658690 0.97 ACE (0.44) ACEDPP4FAPRENDPP8
SCHEMBL30051887 0.89 DPP4 (0.46) ACEDPP4FAPRENDPP8
SCHEMBL29591172 0.87 PREP (0.44) ACEDPP4FAPRENPREP
SCHEMBL30138994 0.87 XIAP (0.43) DPP4FAPDPP8DPP9DPP7
SCHEMBL30139052 0.85 NTSR1 (0.40) ACERENPREPXIAP
SCHEMBL29350794 0.82 ACE (0.50) ACEDPP4FAPRENDPP8
SCHEMBL30138987 0.82 REN (0.48) ACEDPP4FAPRENPREP
SCHEMBL29464995 0.81 XIAP (0.48) ACEDPP4FAPDPP8DPP9
SCHEMBL30558183 0.81 MEN1 (0.44) ACEMAPT
SCHEMBL30485831 0.81 ACE (0.43) ACEDPP4FAPRENDPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115181173-A Preparation method of Tirzepatide 深圳市健元医药科技有限公司 2022-10-14 — — CN claimed
Send feedback