SCHEMBL29530605

SCHEMBL29530605

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

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 1/20 0.49
▸ ACE P12821 2/20 0.46
▸ REN P00797 1/20 0.46
▸ SLC6A2 P23975 2/20 0.43
▸ CAPN1 P07384 6/20 0.43
▸ CTSB P07858 1/20 0.42
▸ CMA1 P23946 1/20 0.41
▸ GRB2 P62993 1/20 0.41
▸ CALCRL Q16602 1/20 0.40
▸ ELANE P08246 1/20 0.40
▸ DPP3 Q9NY33 1/20 0.39
▸ PTPN1 P18031 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
SCHEMBL30687535 0.90 CAPN1 (0.47) XIAPACERENSLC6A2CAPN1
SCHEMBL29630674 0.89 CAPN1 (0.53) XIAPSLC6A2CAPN1CTSBGRB2
SCHEMBL29530904 0.89 XIAP (0.48) XIAPACESLC6A2CAPN1GRB2
SCHEMBL29531054 0.88 SLC6A2 (0.47) XIAPACERENSLC6A2CAPN1
SCHEMBL31484229 0.87 CAPN1 (0.51) XIAPACERENSLC6A2CAPN1
SCHEMBL30441296 0.87 XIAP (0.52) XIAPSLC6A2CAPN1CTSBGRB2
SCHEMBL30311207 0.86 XIAP (0.53) XIAPACERENSLC6A2CAPN1
SCHEMBL29530800 0.86 XIAP (0.54) XIAPACERENSLC6A2CAPN1
SCHEMBL29530598 0.84 XIAP (0.53) XIAPSLC6A2CAPN1CTSBCMA1
Acetic Acid SCHEMBL30311100 0.84 XIAP (0.52) XIAPACERENSLC6A2CMA1

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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