SCHEMBL29530598

SCHEMBL29530598

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

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 2/20 0.53
▸ SLC6A2 P23975 2/20 0.42
▸ CAPN1 P07384 4/20 0.41
▸ DPP4 P27487 1/20 0.41
▸ PREP P48147 1/20 0.41
▸ DPP7 Q9UHL4 1/20 0.41
▸ CTSB P07858 1/20 0.41
▸ ELANE P08246 6/20 0.40
▸ CALCRL Q16602 1/20 0.39
▸ CMA1 P23946 1/20 0.39
▸ MLX Q9UH92 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
SCHEMBL16330317 0.91 XIAP (0.47) XIAPSLC6A2DPP4PREPDPP7
SCHEMBL16351062 0.91 XIAP (0.47) XIAPSLC6A2DPP4PREPDPP7
SCHEMBL16339217 0.91 XIAP (0.47) XIAPSLC6A2DPP4PREPDPP7
SCHEMBL24419898 0.89 XIAP (0.54) XIAPSLC6A2CAPN1DPP4PREP
SCHEMBL34461107 0.89 XIAP (0.54) XIAPSLC6A2CAPN1DPP4PREP
SCHEMBL30866244 0.89 XIAP (0.54) XIAPSLC6A2CAPN1DPP4PREP
SCHEMBL29866553 0.88 XIAP (0.52) XIAPSLC6A2CAPN1CTSBELANE
SCHEMBL29630674 0.87 CAPN1 (0.53) XIAPSLC6A2CAPN1CTSBELANE
SCHEMBL16351007 0.87 XIAP (0.44) XIAPSLC6A2CAPN1DPP4PREP
SCHEMBL16338919 0.87 XIAP (0.44) XIAPSLC6A2CAPN1DPP4PREP

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-12312390-B2 Rapid-acting insulin analogues of enhanced stability CASE WESTERN RESERVE UNIVERSITY (US) 2025-05-27 — — US disclosed
US-20220112262-A1 RAPID-ACTING INSULIN ANALOGUES OF ENHANCED STABILITY CASE WESTERN RESERVE UNIVERSITY 2022-04-14 — — US disclosed
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