SCHEMBL6473069

SCHEMBL6473069

CC(C)C[C@H](NC(=O)COc1ccccc1I)C(=O)N[C@@H](Cc1ccc(OC(=O)N2CCC(NC(=O)CC3CCCCC3)CC2)cc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
YAP1 P46937 8/20 0.46
REN P00797 2/20 0.41
PSMB11 A5LHX3 2/20 0.41
PSMA7 O14818 2/20 0.41
PSMB1 P20618 2/20 0.41
PSMA1 P25786 2/20 0.41
PSMA2 P25787 2/20 0.41
PSMA3 P25788 2/20 0.41
PSMA4 P25789 2/20 0.41
PSMB8 P28062 2/20 0.41
PSMB9 P28065 2/20 0.41
PSMA5 P28066 2/20 0.41
PSMB4 P28070 2/20 0.41
PSMB6 P28072 2/20 0.41
PSMB5 P28074 2/20 0.41
PSMB10 P40306 2/20 0.41
PSMB3 P49720 2/20 0.41
PSMB2 P49721 2/20 0.41
PSMA6 P60900 2/20 0.41
PSMA8 Q8TAA3 2/20 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
SCHEMBL6478253 0.92 L3MBTL1 (0.42) YAP1RENPSMB11PSMA7PSMB1
SCHEMBL6474177 0.92 CASP1 (0.49) YAP1RENPSMB11PSMA7PSMB1
SCHEMBL6473896 0.91 PSMB11 (0.44) YAP1PSMB11PSMA7PSMB1PSMA1
SCHEMBL6480778 0.91 YAP1 (0.48) YAP1RENPSMB11PSMA7PSMB1
SCHEMBL6481246 0.89 PSMB11 (0.45) YAP1PSMB11PSMA7PSMB1PSMA1
SCHEMBL6480786 0.87 MAPK1 (0.44) YAP1RENPSMB11PSMA7PSMB1
SCHEMBL6479940 0.86 ITGB1 (0.47) YAP1PSMB11PSMA7PSMB1PSMA1
SCHEMBL7538622 0.86 ITGB1 (0.47) YAP1PSMB11PSMA7PSMB1PSMA1
SCHEMBL6472835 0.85 CASP1 (0.51) YAP1PSMB11PSMA7PSMB1PSMA1
SCHEMBL6474041 0.85 CTSS (0.45) PSMB11PSMA7PSMB1PSMA1PSMA2

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
US-6867192-B1 Compounds useful in the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2005-03-15 US claimed
EP-1140837-B1 COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES GLAXO GROUP LTD (GB) 2004-08-18 EP claimed
US-6867192-B1 Compounds useful in the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2005-03-15 US disclosed
EP-1140837-B1 COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES GLAXO GROUP LTD (GB) 2004-08-18 EP disclosed