SCHEMBL7438347

SCHEMBL7438347

CC(C)(C)OC(=O)CC(NC(=O)OCc1ccccc1)C(=O)Cn1nnnc1-c1cccc(-c2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 12/20 0.41
SYK P43405 1/20 0.40
CTSB P07858 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
ATM Q13315 1/20 0.39
MGLL Q99685 1/20 0.39
MAPT P10636 1/20 0.39
KLK7 P49862 1/20 0.39
KLK5 Q9Y337 1/20 0.39
MME P08473 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
SCHEMBL7433669 0.94 ATM (0.43) CASP1SYKCTSKATMMAPT
SCHEMBL7435672 0.94 ATM (0.44) CASP1SYKCTSBCTSSCTSK
SCHEMBL7443609 0.90 CASP1 (0.42) CASP1SYKCTSBCTSSCTSK
SCHEMBL7438326 0.89 CASP1 (0.50) CASP1
SCHEMBL7431145 0.88 MAPT (0.41) CASP1SYKATMMAPT
SCHEMBL7442691 0.88 CASP1 (0.46) CASP1SYKATMMAPTKLK7
SCHEMBL7441949 0.87 CASP3 (0.42) CASP1SYKATMMAPT
SCHEMBL7441638 0.86 CASP1 (0.46) CASP1SYKATMKLK7KLK5
SCHEMBL7441581 0.86 CASP1 (0.40) CASP1SYKCTSKATMMAPT
SCHEMBL7433459 0.85 CASP1 (0.41) CASP1SYKATMMAPTKLK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5710153-A INTERLEUKIN CONVERTING ENZYME INHIBITORS ONO PHRAMACEUTICAL CO., LTD. (JP) 1998-01-20 US disclosed
EP-0761680-A2 Tetrazole compounds having Interleukin-1beta converting enzyme inhibitory activity ONO PHARMACEUTICAL CO., LTD. (JP) 1997-03-12 EP disclosed