SCHEMBL7448172

SCHEMBL7448172

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MMP14 P50281 2/20 0.40
ADAMTS5 Q9UNA0 1/20 0.40
MAPT P10636 2/20 0.39
GAA P10253 1/20 0.39
CA2 P00918 3/20 0.39
CA1 P00915 2/20 0.39
CA7 P43166 2/20 0.39
HSD11B1 P28845 1/20 0.38
HDAC1 Q13547 2/20 0.38
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 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
SCHEMBL8096459 0.84 MEN1 (0.49) MEN1KMT2AMMP14ADAMTS5MAPT
SCHEMBL8109659 0.78 MEN1 (0.52) MEN1KMT2AMMP14ADAMTS5MAPT
SCHEMBL28895576 0.72 MEN1 (0.56) MEN1KMT2AMMP14ADAMTS5MAPT
SCHEMBL4675462 0.72 HDAC1 (0.41) MEN1KMT2AMMP14ADAMTS5MAPT
SCHEMBL4675456 0.72 HDAC1 (0.41) MEN1KMT2AMMP14ADAMTS5MAPT
SCHEMBL8550694 0.68 MEN1 (0.48) MEN1KMT2AMMP14ADAMTS5MAPT
SCHEMBL4673636 0.68 MMP14 (0.51) MEN1KMT2AMMP14ADAMTS5MAPT
SCHEMBL4673959 0.68 GRM5 (0.41) MEN1KMT2AMMP14ADAMTS5MAPT
SCHEMBL7445507 0.67 GRM5 (0.43) MEN1KMT2AMMP14ADAMTS5MAPT
SCHEMBL7448674 0.67 MAPT (0.53) MEN1KMT2AMMP14ADAMTS5MAPT

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