SCHEMBL6160794

SCHEMBL6160794

CC(CC(=O)NCCc1ccccc1)C(=O)NC(CC(=O)O)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
MEN1 O00255 1/20 0.51
TSHR P16473 1/20 0.51
MME P08473 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
CASP1 P29466 1/20 0.48
POLB P06746 1/20 0.48
ANPEP P15144 1/20 0.48
CASP3 P42574 1/20 0.48
CASP6 P55212 1/20 0.48
CASP8 Q14790 1/20 0.48
ITGB3 P05106 1/20 0.47
ITGA2B P08514 1/20 0.47
LMNA P02545 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
ACE P12821 1/20 0.44
MMP1 P03956 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
SCHEMBL6158091 0.88 KMT2A (0.47) KMT2AMEN1TSHRALDH1A1HPGD
SCHEMBL6158841 0.82 KMT2A (0.61) KMT2AMEN1TSHRALDH1A1HPGD
SCHEMBL6158716 0.82 CASP1 (0.60) KMT2AALDH1A1HPGDCASP1POLB
Naphthalene SCHEMBL7417075 0.82 CASP3 (0.51) KMT2AALDH1A1HPGDCASP1CASP3
SCHEMBL2615885 0.80 MME (0.66) TSHRMMEALDH1A1GAAMAPT
SCHEMBL7438292 0.78 KMT2A (0.60) KMT2AMEN1TSHRALDH1A1HPGD
SCHEMBL8670529 0.77 ALDH1A1 (0.58) KMT2AMEN1TSHRALDH1A1HPGD
SCHEMBL11411651 0.77 MME (0.61) MMEALDH1A1ACE
SCHEMBL18426210 0.76 KMT2A (0.58) KMT2AMEN1TSHRALDH1A1HPGD
SCHEMBL6045130 0.76 KMT2A (0.79) KMT2AMEN1TSHRALDH1A1HPGD

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 7 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$g(b) CONVERTING ENZYME WARNER LAMBERT CO (US) 2002-10-09 EP disclosed
CN-1308542-A Succinamide inhibitors of interleukin-1 beta converting enzyme WARNET LAMBERT CO (US) 2001-08-15 CN disclosed
EP-1082127-A1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1$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
EP-0932598-A1 ASPARTATE ESTER INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1999-08-04 EP disclosed
WO-1998016502-A1 ASPARTATE ESTER INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1998-04-23 WO disclosed