SCHEMBL8087773

SCHEMBL8087773

COc1ccc(C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)OC(C)(C)C)C(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
ALDH1A1 P00352 2/20 0.50
KMT2A Q03164 2/20 0.50
HTT P42858 1/20 0.50
ELANE P08246 11/20 0.49
MEN1 O00255 1/20 0.48
PREP P48147 1/20 0.48
ACE P12821 1/20 0.47
CTSG P08311 1/20 0.46
CMA1 P23946 1/20 0.45
TAAR1 Q96RJ0 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
SCHEMBL3470215 1.00 LMNA (0.50) LMNAALDH1A1KMT2AHTTELANE
SCHEMBL10573052 0.91 ELANE (0.51) ELANEPREPCTSGCMA1TAAR1
SCHEMBL22209430 0.91 LMNA (0.53) LMNAALDH1A1KMT2AHTTELANE
SCHEMBL18619671 0.91 LMNA (0.53) LMNAALDH1A1KMT2AHTTELANE
SCHEMBL3472006 0.89 STAT6 (0.47) LMNAALDH1A1KMT2AHTTELANE
SCHEMBL13928443 0.89 STAT6 (0.47) LMNAALDH1A1KMT2AHTTELANE
SCHEMBL7362814 0.87 LMNA (0.53) LMNAALDH1A1KMT2AHTTELANE
SCHEMBL3471466 0.87 LMNA (0.53) LMNAALDH1A1KMT2AHTTELANE
SCHEMBL20484733 0.87 LMNA (0.53) LMNAALDH1A1KMT2AHTTELANE
SCHEMBL13924699 0.84 ELANE (0.56) LMNAALDH1A1KMT2AHTTELANE

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6037363-A Diastereomeric pure trifluoromethyl ketone peptide derivatives as inhibitors of human leukocyte elastase ZENECA LIMITED (GB) 2000-03-14 US disclosed
US-5907043-A Diastereomeric pure trifluoromethyl ketone peptide derivatives as inhibitors of human leukocyte elastase ZENECA LIMITED (GB) 1999-05-25 US disclosed
US-5739157-A Diastereomeric pure trifluoromethyl ketone peptide derivatives as inhibitors of human leukocyte elastase ZENECA LIMITED (GB) 1998-04-14 US disclosed