SCHEMBL20611525

SCHEMBL20611525

CC(C)NC(=O)C1CCCCN1C(=O)C1CCCN1C(=O)CCOC=O

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 1/20 0.36
▸ PREP P48147 1/20 0.36
▸ CAPN1 P07384 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
SCHEMBL24590886 0.93 ACE (0.35) ACEPREP
SCHEMBL20611442 0.88 ACE (0.34) ACECAPN1
SCHEMBL24590883 0.87 ACE (0.40) ACEPREP
SCHEMBL24590855 0.85 FKBP1A (0.37) —
SCHEMBL20611696 0.84 FKBP1A (0.38) —
SCHEMBL24590897 0.84 F2 (0.32) ACECAPN1
SCHEMBL19943848 0.84 F2 (0.32) ACECAPN1
SCHEMBL24590869 0.82 PREP (0.36) PREPCAPN1
SCHEMBL20611422 0.79 FKBP1A (0.33) —
SCHEMBL24590933 0.79 FKBP1A (0.33) —

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
EP-3265083-B1 SUBSTITUTED UREA DEPSIPEPTIDE ANALOGS AS ACTIVATORS OF THE CLPP ENDOPEPTIDASE ST JUDE CHILDRENS RES HOSPITAL (US) 2022-07-06 — — EP disclosed
EP-3038640-B1 SUBSTITUTED UREA DEPSIPEPTIDE ANALOGS AS ACTIVATORS OF THE CLPP ENDOPEPTIDASE ST JUDE CHILDRENS RES HOSPITAL (US) 2019-01-02 — — EP disclosed
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