SCHEMBL31628587

SCHEMBL31628587

Cc1cccc(Cc2nnc(C(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H](NC(=O)OCc3ccccc3)C(C)C)C(C)C)o2)c1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ELANE P08246 16/20 0.51
CAPN1 P07384 2/20 0.46
CMA1 P23946 1/20 0.46
MALT1 Q9UDY8 1/20 0.44

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
SCHEMBL7004717 1.00 ELANE (0.51) ELANECAPN1CMA1MALT1
SCHEMBL29427202 0.88 ELANE (0.49) ELANECAPN1CMA1MALT1
SCHEMBL32682555 0.87 ELANE (0.46) ELANECAPN1CMA1
SCHEMBL7004057 0.86 CMA1 (0.47) ELANECMA1
SCHEMBL13814740 0.85 ELANE (0.53) ELANECAPN1CMA1MALT1
SCHEMBL7286279 0.80 CAPN1 (0.51) ELANECAPN1CMA1MALT1
SCHEMBL9744941 0.79 ELANE (0.81) ELANE
SCHEMBL7289203 0.79 ELANE (0.81) ELANE
SCHEMBL9745389 0.78 ELANE (0.66) ELANE
SCHEMBL1506200 0.77 ALDH1A1 (0.62) ELANECAPN1CMA1

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
US-20250195630-A1 COMPOSITIONS, METHODS AND USES OF ALPHA 1-ANTITRYPSIN FOR TREATMENT OF GRAFT VERSUS HOST DISEASE THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE 2025-06-19 US disclosed