SCHEMBL8746476

SCHEMBL8746476

CC(C)[C@H](NS(=O)(=O)N(C)C)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
MMP2 P08253 12/20 0.44
MMP9 P14780 12/20 0.44
MMP3 P08254 10/20 0.44
MMP13 P45452 10/20 0.44
MMP1 P03956 9/20 0.44
MMP7 P09237 9/20 0.44
ADAMTS4 O75173 3/20 0.44
MMP14 P50281 1/20 0.41
MMP8 P22894 1/20 0.40

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
SCHEMBL8381845 1.00 KDM4E (0.49) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL8381843 1.00 KDM4E (0.49) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL5789286 0.78 CA2 (0.42) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL30447725 0.78 CA2 (0.42) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL5839738 0.76 KDM4E (0.49) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL29612792 0.76 KDM4E (0.49) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL5839741 0.76 KDM4E (0.49) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL13612445 0.74 KDM4E (0.47) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL9115909 0.74 KDM4E (0.47) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL7477399 0.74 MMP2 (0.47) KDM4EMMP2MMP9MMP3MMP13

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
EP-0758317-A1 N-SULPHONYL AND N-SULPHINYL AMINO ACID AMIDES AS MICROBIOCIDES Novartis AG (CH) 1997-02-19 EP disclosed
WO-1995030651-A1 N-SULPHONYL AND N-SULPHINYL AMINO ACID AMIDES AS MICROBIOCIDES CIBA-GEIGY AG (CH) 1995-11-16 WO disclosed