SCHEMBL30661441

SCHEMBL30661441

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 1/20 0.47
▸ ACE P12821 7/20 0.47
▸ REN P00797 4/20 0.43
▸ DPP4 P27487 3/20 0.42
▸ FAP Q12884 2/20 0.42
▸ DPP7 Q9UHL4 2/20 0.42
▸ PREP P48147 1/20 0.42
▸ DPP8 Q6V1X1 1/20 0.42
▸ DPP9 Q86TI2 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.40
▸ F2 P00734 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ LTA4H P09960 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PEPD P12955 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ HRH1 P35367 1/20 0.40

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
SCHEMBL30661450 1.00 XIAP (0.47) XIAPACERENDPP4FAP
SCHEMBL31307897 0.89 ACE (0.45) XIAPACERENKDM4EF2
SCHEMBL31564810 0.88 FAP (0.44) XIAPACERENDPP4FAP
SCHEMBL30577828 0.88 XIAP (0.50) XIAPACERENDPP4FAP
SCHEMBL6656423 0.87 ACE (0.49) XIAPACERENDPP4FAP
SCHEMBL16620343 0.87 ACE (0.49) XIAPACERENDPP4FAP
SCHEMBL31670620 0.86 ACE (0.42) XIAPACERENDPP4FAP
SCHEMBL30575175 0.85 DPP4 (0.48) DPP4FAPDPP7DPP8DPP9
SCHEMBL29569027 0.83 XIAP (0.53) XIAPACERENDPP4FAP
SCHEMBL29565573 0.82 ACE (0.42) XIAPACERENDPP4FAP

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-117229380-A Preparation and application of prinsepia utilis royle peptide complex 昆明理工大学 2023-12-15 — — CN disclosed
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