SCHEMBL7753344

SCHEMBL7753344

CCc1ccccc1S(=O)(=O)NC(CC(=O)OCOC(=O)C(C)(C)C)NC(=O)CCNC(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 1/20 0.37
SYK P43405 1/20 0.34
NQO2 P16083 1/20 0.34
CA1 P00915 5/20 0.33
CA2 P00918 5/20 0.33
IDO1 P14902 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
REN P00797 1/20 0.32
CTSS P25774 3/20 0.32
CTSK P43235 3/20 0.32
KCNA5 P22460 1/20 0.32
BCHE P06276 1/20 0.32
KDM4E B2RXH2 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CCKBR P32239 1/20 0.32
ACE P12821 1/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL7748709 0.89 CACNA1B (0.36) SYKCA1CTSSCTSKCA12
SCHEMBL27463759 0.80 MAPT (0.38) MALT1NQO2CA1CA2ALOX5AP
SCHEMBL7753688 0.79 MEN1 (0.40) MALT1CA1CA2
SCHEMBL7748713 0.78 SYK (0.40) MALT1SYKNQO2CA1CTSS
SCHEMBL7748601 0.76 NQO2 (0.38) MALT1NQO2CA1CA2
SCHEMBL27407231 0.73 CA2 (0.38) MALT1SYKNQO2CA1CA2
SCHEMBL7753338 0.70 CA1 (0.43) CA1CA2L3MBTL1CA12CA9
SCHEMBL7414276 0.68 ABCB1 (0.43) MALT1SYKCA1CA2CTSS
SCHEMBL7295520 0.66 SYK (0.53) SYKIDO1CTSSL3MBTL1ACE
SCHEMBL9217103 0.66 SYK (0.53) SYKIDO1CTSSL3MBTL1ACE

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-0725059-B1 2,3-DIAMINOPROPIONIC ACID DERIVATIVE SUMITOMO PHARMA (JP) 2001-01-17 EP disclosed
US-6048854-A ANTICOAGULANTS; ANTICANCER AGENT; WOUND HEALING AGENTS;BONE DISORDERS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-04-11 US disclosed
US-5707994-A USEFUL AS A PLATELET AGGREGATION INHIBITOR, CANCER METASTASIS INHIBITOR, WOUND HEALING AGENT OR A BONE RESORPTION INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-01-13 US disclosed
EP-0725059-A1 2,3-DIAMINOPROPIONIC ACID DERIVATIVE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-08-07 EP disclosed