SCHEMBL9516161

SCHEMBL9516161

CCCCOc1ccc(S(=O)(=O)NC(=O)c2ccc(COC)nc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 2/20 0.53
BCL2L1 Q07817 1/20 0.51
MCL1 Q07820 1/20 0.51
MMP1 P03956 2/20 0.49
ADAMTS4 O75173 1/20 0.49
MMP2 P08253 1/20 0.49
MMP13 P45452 1/20 0.49
MMP14 P50281 1/20 0.49
ADAMTS5 Q9UNA0 1/20 0.49
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47

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
SCHEMBL9515565 0.89 BCL2L1 (0.53) P4HTMBCL2L1MCL1MMP1ADAMTS4
SCHEMBL9519133 0.87 BCL2L1 (0.51) P4HTMBCL2L1MCL1MMP1ADAMTS4
SCHEMBL9519606 0.86 BCL2L1 (0.50) P4HTMBCL2L1MCL1MMP1ADAMTS4
SCHEMBL9516980 0.86 BCL2L1 (0.50) P4HTMBCL2L1MCL1MMP1ADAMTS4
SCHEMBL9516188 0.86 BCL2L1 (0.50) P4HTMBCL2L1MCL1MMP1ADAMTS4
SCHEMBL9517920 0.85 P4HTM (0.51) P4HTMBCL2L1MCL1SMN1; SMN2HDAC3
SCHEMBL9517152 0.84 BCL2L1 (0.48) P4HTMBCL2L1MCL1MMP1ADAMTS4
SCHEMBL8870173 0.83 P4HTM (0.62) P4HTMBCL2L1MCL1MMP1ADAMTS4
SCHEMBL7874636 0.82 P4HTM (0.52) P4HTMBCL2L1MCL1MMP1ADAMTS4
SCHEMBL9515461 0.81 P4HTM (0.62) P4HTMMMP1MMP2MMP13SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0567997-A1 4- or 5-(sulf)imido- and (sulfon)amidopyridines and their pyridine-N-oxides, process for their preparation and their use as pharmaceutical HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-03 EP disclosed