SCHEMBL9018064

SCHEMBL9018064

CCOC(=O)Oc1ccc(C(=O)NS(=O)(=O)CCc2ccc(OC)cc2)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.46
MMP12 P39900 1/20 0.46
MMP13 P45452 1/20 0.46
KMT2A Q03164 5/20 0.45
MEN1 O00255 2/20 0.45
MAPT P10636 4/20 0.43
NOX1 Q9Y5S8 1/20 0.42
P4HTM Q9NXG6 1/20 0.42
GLA P06280 1/20 0.41
HDAC1 Q13547 1/20 0.41
GABRA5 P31644 1/20 0.41
NPC1 O15118 3/20 0.39
OPRM1 P35372 2/20 0.39
OPRD1 P41143 2/20 0.39
RAB9A P51151 2/20 0.39
PTGER4 P35408 1/20 0.39
OPRK1 P41145 1/20 0.39
VNN1 O95497 1/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39

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
SCHEMBL9018493 0.92 MMP8 (0.49) MMP8MMP12MMP13KMT2AMEN1
SCHEMBL9018373 0.89 CXCR2 (0.48) KMT2AMEN1MAPTGABRA5ALDH1A1
SCHEMBL9018485 0.89 GABRA5 (0.49) MMP8MMP12MMP13MAPTP4HTM
SCHEMBL9018172 0.87 MMP8 (0.47) MMP8MMP12MMP13KMT2AMEN1
SCHEMBL9139049 0.85 P4HTM (0.50) MMP8MMP12MMP13KMT2AMEN1
SCHEMBL9018335 0.85 P4HTM (0.60) MMP8MMP13KMT2AMEN1MAPT
SCHEMBL9018160 0.83 GABRA5 (0.51) MAPTP4HTMHDAC1GABRA5NPC1
SCHEMBL9018260 0.82 KMT2A (0.54) KMT2AMEN1MAPTP4HTMGLA
SCHEMBL7871632 0.82 KMT2A (0.51) MMP8MMP12MMP13KMT2AMEN1
SCHEMBL7862742 0.82 KMT2A (0.51) MMP8MMP12MMP13KMT2AMEN1

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-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