SCHEMBL5969999

SCHEMBL5969999

COC(=O)CNC(=O)c1[nH]c2ccccc2c1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
HSD17B10 Q99714 2/20 0.58
MCL1 Q07820 2/20 0.57
MAPT P10636 2/20 0.54
USP2 O75604 1/20 0.54
HPGD P15428 1/20 0.54
HTT P42858 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
KDM4E B2RXH2 1/20 0.51
GAA P10253 1/20 0.51
HDAC3 O15379 1/20 0.49
HDAC1 Q13547 1/20 0.49
ALOX5 P09917 1/20 0.49
EGFR P00533 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
MAOA P21397 1/20 0.45
NR4A2 P43354 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 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
SCHEMBL5970635 0.86 MCL1 (0.55) ALDH1A1HSD17B10MCL1MAPTUSP2
SCHEMBL18041151 0.82 HDAC3 (0.66) ALDH1A1HSD17B10MCL1MAPTUSP2
SCHEMBL7675702 0.79 GAA (0.63) ALDH1A1HSD17B10MAPTUSP2HPGD
SCHEMBL17447465 0.78 ALDH1A1 (0.55) ALDH1A1HSD17B10MCL1MAPTUSP2
SCHEMBL30595729 0.77 ALDH1A1 (0.56) ALDH1A1HSD17B10MAPTUSP2HPGD
SCHEMBL29736213 0.77 ALDH1A1 (0.65) ALDH1A1HSD17B10MAPTUSP2HPGD
SCHEMBL7338590 0.77 ALDH1A1 (0.56) ALDH1A1HSD17B10MAPTUSP2HPGD
SCHEMBL5508274 0.77 ALDH1A1 (0.65) ALDH1A1HSD17B10MAPTUSP2HPGD
SCHEMBL26572014 0.76 KDM4E (0.80) ALDH1A1HSD17B10MCL1MAPTHPGD
SCHEMBL30571503 0.76 KDM4E (0.80) ALDH1A1HSD17B10MCL1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0929311-B8 INHIBITION OF APOPTOSIS USING INTERLEUKIN-1 beta-CONVERTING ENZYME (ICE)/CED-3 FAMILY INHIBITORS IDUN PHARMACEUTICALS INC (US) 2006-02-01 EP disclosed
EP-1443935-A2 TREATMENT OF INFECTIOUS DISEASE USING INTERLEUKIN-1 BETA CONVERTING ENZYME (ICE)/CED-3 FAMILY INHIBITORS Idun Pharmaceuticals, Inc. (US) 2004-08-11 EP disclosed
WO-2003032918-A2 TREATMENT OF INFECTIOUS DISEASE USING INTERLEUKIN-1 BETA CONVERTING ENZYME (ICE)/CED-3 FAMILY INHIBITORS IDUN PHARMACEUTICALS, INC. (US) 2003-04-24 WO disclosed
WO-2002070544-A2 METHODS, COMPOSITIONS AND KITS FOR PRESERVING ANTIGENICITY IDUN PHARMACEUTICALS, INC. (US) 2002-09-12 WO disclosed
EP-1159291-A1 C-TERMINAL MODIFIED (N-SUBSTITUTED)-2-INDOLYLCARBONYLDIPEPTIDES AS INHIBITORS OF THE ICE/CED-3 FAMILY OF CYSTEINE PROTEASES Idun Pharmaceuticals, Inc. (US) 2001-12-05 EP disclosed
EP-0929311-A4 INHIBITION OF APOPTOSIS USING INTERLEUKIN-1 beta-CONVERTING ENZYME (ICE)/CED-3 FAMILY INHIBITORS IDUN PHARMACEUTICALS INC (US) 2001-08-29 EP disclosed
WO-2001000658-A1 C-TERMINAL MODIFIED (N-SUBSTITUTED)-2-INDOLYLCARBONYLDIPEPTIDES AS INHIBITORS OF THE ICE/CED-3 FAMILY OF CYSTEINE PROTEASES IDUN PHARMACEUTICALS, INC. (US) 2001-01-04 WO disclosed
EP-0929311-A1 INHIBITION OF APOPTOSIS USING INTERLEUKIN-1 beta-CONVERTING ENZYME (ICE)/CED-3 FAMILY INHIBITORS Idun Pharmaceuticals, Inc. (US) 1999-07-21 EP disclosed
EP-0920444-A1 C-TERMINAL MODIFIED (N-SUBSTITUTED)-2-INDOLYL DIPEPTIDES AS INHIBITORS OF THE ICE/ced-3 FAMILY OF CYSTEINE PROTEASES Idun Pharmaceuticals, Inc. (US) 1999-06-09 EP disclosed
WO-1998010778-A1 INHIBITION OF APOPTOSIS USING INTERLEUKIN-1β-CONVERTING ENZYME (ICE)/CED-3 FAMILY INHIBITORS IDUN PHARMACEUTICALS, INC. (US) 1998-03-19 WO disclosed
WO-1998011129-A1 C-TERMINAL MODIFIED (N-SUBSTITUTED)-2-INDOLYL DIPEPTIDES AS INHIBITORS OF THE ICE/ced-3 FAMILY OF CYSTEINE PROTEASES IDUN PHARMACEUTICALS, INCORPORATED (US) 1998-03-19 WO disclosed