SCHEMBL6160486

SCHEMBL6160486

COC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)[C@@H](CC(=O)NCCOc1ccccc1)C(C)C

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 8/20 0.59
RECQL P46063 1/20 0.41
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
HPGD P15428 3/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
CASP3 P42574 1/20 0.40
RAB9A P51151 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
ALDH1A1 P00352 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MMP1 P03956 1/20 0.39
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
SUCNR1 Q9BXA5 1/20 0.38

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
SCHEMBL6160484 1.00 CASP1 (0.59) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6157556 1.00 CASP1 (0.59) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6159101 0.92 CASP1 (0.61) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6159062 0.92 CASP1 (0.61) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6159063 0.92 CASP1 (0.61) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6157550 0.91 CASP1 (0.59) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6158544 0.84 CASP1 (0.58) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6158531 0.80 CASP1 (0.60) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6159753 0.77 CASP1 (0.68) CASP1RECQLMTNR1AMTNR1BHPGD
SCHEMBL6159749 0.77 CASP1 (0.68) 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