SCHEMBL7445507

SCHEMBL7445507

CCCC(C(=O)OCc1ccccc1)[C@@](N)(NS(=O)(=O)N1CCN(c2ccc(Cl)cc2)CC1)C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.43
MMP14 P50281 1/20 0.42
ADAMTS5 Q9UNA0 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
TP53 P04637 1/20 0.38
TMEM97 Q5BJF2 2/20 0.38
SIGMAR1 Q99720 2/20 0.38
LMNA P02545 1/20 0.37
THRB P10828 1/20 0.37
DRD4 P21917 1/20 0.36
BCL2 P10415 1/20 0.36
BCL2L1 Q07817 1/20 0.36
MCL1 Q07820 1/20 0.36
BCL2A1 Q16548 1/20 0.36

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
SCHEMBL8096459 0.74 MEN1 (0.49) MMP14ADAMTS5MAPTMEN1KMT2A
SCHEMBL4673959 0.73 GRM5 (0.41) GRM5MMP14ADAMTS5POLBMAPT
SCHEMBL8109659 0.71 MEN1 (0.52) MMP14ADAMTS5POLBMAPTMEN1
SCHEMBL4673787 0.69 MMP2 (0.64) MMP14
SCHEMBL4673790 0.69 MMP2 (0.64) MMP14
SCHEMBL4675059 0.69 RORC (0.48) GRM5MAPTMEN1KMT2ATP53
SCHEMBL4675062 0.69 RORC (0.48) GRM5MAPTMEN1KMT2ATP53
SCHEMBL7448674 0.68 MAPT (0.53) MMP14ADAMTS5POLBMAPTMEN1
SCHEMBL4673538 0.67 MMP2 (0.55) GRM5MMP14ADAMTS5POLBMAPT
SCHEMBL4673540 0.67 MMP2 (0.55) GRM5MMP14ADAMTS5POLBMAPT

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-0958287-A1 SULFAMIDE-METALLOPROTEASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 1999-11-24 EP disclosed
WO-1998032748-A1 SULFAMIDE-METALLOPROTEASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 1998-07-30 WO disclosed