SCHEMBL6159566

SCHEMBL6159566

C=CC(CC(=O)OCC)NC(=O)C(CC(=O)NCCOc1ccccc1)C(C)C

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 14/20 0.67
KDM1A O60341 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
RECQL P46063 1/20 0.43
HPGD P15428 1/20 0.42
KDM4E B2RXH2 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
SCHEMBL6157176 0.91 CASP1 (0.80) CASP1
SCHEMBL6158531 0.84 CASP1 (0.60) CASP1KDM1ASMN1; SMN2RECQLHPGD
SCHEMBL6160822 0.83 CASP1 (0.59) CASP1KDM1ASMN1; SMN2RECQLHPGD
SCHEMBL6159571 0.79 CASP1 (0.44) CASP1
SCHEMBL6160049 0.76 CASP1 (0.66) CASP1SMN1; SMN2RECQLHPGDKDM4E
SCHEMBL6160484 0.74 CASP1 (0.59) CASP1RECQLHPGDKDM4E
SCHEMBL6157556 0.74 CASP1 (0.59) CASP1RECQLHPGDKDM4E
SCHEMBL6160486 0.74 CASP1 (0.59) CASP1RECQLHPGDKDM4E
SCHEMBL6159584 0.73 CASP1 (0.70) CASP1RECQLHPGDKDM4E
SCHEMBL6159062 0.73 CASP1 (0.61) CASP1RECQLHPGDKDM4E

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