SCHEMBL17029372

SCHEMBL17029372

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

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 2/20 0.44
▸ APLNR P35414 1/20 0.39
▸ MMP3 P08254 3/20 0.37
▸ MMP1 P03956 2/20 0.37
▸ CAPN1 P07384 4/20 0.37
▸ STAT3 P40763 7/20 0.36
▸ F2 P00734 1/20 0.35
▸ F10 P00742 1/20 0.35
▸ PLG P00747 1/20 0.35
▸ PRSS1 P07477 1/20 0.35
▸ CTSB P07858 1/20 0.35
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL10297425 1.00 REN (0.44) RENAPLNRMMP3MMP1CAPN1
SCHEMBL10297453 1.00 REN (0.44) RENAPLNRMMP3MMP1CAPN1
SCHEMBL10297468 0.96 REN (0.44) RENAPLNRMMP3MMP1CAPN1
SCHEMBL10297439 0.96 REN (0.44) RENAPLNRMMP3MMP1CAPN1
SCHEMBL29463850 0.90 REN (0.40) RENAPLNRF2F10PLG
SCHEMBL10297429 0.87 ELANE (0.40) REN
SCHEMBL10297455 0.87 ELANE (0.40) REN
SCHEMBL17029371 0.87 ELANE (0.40) REN
SCHEMBL14479877 0.86 REN (0.53) REN
SCHEMBL10297433 0.86 REN (0.53) REN

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-9114104-B2 Proteinase K inhibitors, methods and compositions therefor Life Technologies Corporation (US) 2015-08-25 — — US disclosed
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