SCHEMBL7874636

SCHEMBL7874636

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 2/20 0.52
BCL2L1 Q07817 1/20 0.50
MCL1 Q07820 1/20 0.50
MMP1 P03956 2/20 0.48
ADAMTS4 O75173 1/20 0.48
MMP2 P08253 1/20 0.48
MMP13 P45452 1/20 0.48
MMP14 P50281 1/20 0.48
ADAMTS5 Q9UNA0 1/20 0.48
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
LMNA P02545 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.46
EGFR P00533 2/20 0.45
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44

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
SCHEMBL9017985 0.88 P4HTM (0.66) P4HTMMMP1MMP2MMP13LMNA
SCHEMBL9018436 0.88 CA2 (0.46) P4HTMTP53LMNAEGFRCYP2C9
SCHEMBL9018027 0.86 CA2 (0.52) P4HTMLMNAEGFRCYP2C9TSHR
SCHEMBL9018259 0.86 LIMK1 (0.45) P4HTMBCL2L1MCL1EGFRHDAC3
SCHEMBL7871651 0.85 BCL2L1 (0.46) P4HTMBCL2L1MCL1MMP1ADAMTS4
SCHEMBL9018004 0.85 P4HTM (0.48) P4HTMBCL2L1MCL1EGFR
SCHEMBL9018165 0.84 PTPN1 (0.51) P4HTMMAPTSMN1; SMN2CYP2C9
SCHEMBL9018185 0.84 RAB9A (0.55) P4HTMBCL2L1MCL1SMN1; SMN2NPC1
SCHEMBL9018106 0.84 MCL1 (0.59) P4HTMBCL2L1MCL1MMP1ADAMTS4
SCHEMBL7870518 0.83 P4HTM (0.64) P4HTMBCL2L1MCL1LMNAEGFR

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-0562512-B1 Sulfonamidocarbonylpyridine-2-carboxamides and their use as medicines HOECHST AG (DE) 2001-02-21 EP disclosed
EP-0590520-B1 Acylsulphonamido and sulphonamidopyridine-2-carboxylic acid esters, pyridine-n-oxides thereof, a process for their preparation and their use as medicaments HOECHST AG (DE) 1996-06-12 EP disclosed
EP-0590520-A1 Acylsulphonamido and sulphonamidopyridine-2-carboxylic acid esters, pyridine-n-oxides thereof, a process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1994-04-06 EP disclosed
EP-0562512-A1 Sulfonamido- and sulfonamidocarbonyl-pyridine-2-carboxamides and their pyridine-N-oxides, process for their preparation and their use as medicines HOECHST AKTIENGESELLSCHAFT (DE) 1993-09-29 EP disclosed