SCHEMBL6159749

SCHEMBL6159749

CC(C)C(CC(=O)NCCOc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)CBr

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 15/20 0.68
RECQL P46063 1/20 0.46
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL6159753 1.00 CASP1 (0.68) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6159584 0.80 CASP1 (0.70) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6160049 0.79 CASP1 (0.66) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6159063 0.78 CASP1 (0.61) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6159101 0.78 CASP1 (0.61) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6159062 0.78 CASP1 (0.61) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6158531 0.77 CASP1 (0.60) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6160484 0.77 CASP1 (0.59) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6160486 0.77 CASP1 (0.59) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6157556 0.77 CASP1 (0.59) CASP1RECQLMTNR1AMTNR1BHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1082127-B1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1BETA CONVERTING ENZYME WARNER LAMBERT CO (US) 2005-06-22 EP disclosed
EP-1082127-A4 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER LAMBERT CO (US) 2002-10-09 EP disclosed
EP-1082127-A1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 2001-03-14 EP disclosed
WO-1999056765-A1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1999-11-11 WO disclosed