SCHEMBL9018067

SCHEMBL9018067

CC(C)CC(=O)NCCc1ccc(S(=O)(=O)NC(=O)c2ccc(OC(=O)OC(C)C)nc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
ALDH1A1 P00352 3/20 0.39
POLB P06746 1/20 0.39
P4HTM Q9NXG6 2/20 0.39
EGFR P00533 2/20 0.39
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
RAB9A P51151 1/20 0.37
HTT P42858 1/20 0.37
EPHX2 P34913 1/20 0.37

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
SCHEMBL9018063 0.94 LMNA (0.44) LMNAALDH1A1POLBP4HTMEGFR
SCHEMBL9018081 0.92 LMNA (0.39) LMNAALDH1A1POLBP4HTMEGFR
SCHEMBL9018549 0.91 LMNA (0.43) LMNAALDH1A1POLBP4HTMEGFR
SCHEMBL9018069 0.91 MEN1 (0.46) LMNAALDH1A1POLBP4HTMEGFR
SCHEMBL9017984 0.90 ALDH1A1 (0.47) LMNAALDH1A1POLBP4HTMEGFR
SCHEMBL9018443 0.89 CA1 (0.37) LMNAALDH1A1POLBP4HTMEGFR
SCHEMBL9018026 0.89 P4HTM (0.40) LMNAALDH1A1P4HTMEGFROPRM1
SCHEMBL9018110 0.89 ALDH1A1 (0.46) LMNAALDH1A1POLBP4HTMOPRM1
SCHEMBL9018475 0.89 CA1 (0.47) ALDH1A1POLBP4HTMOPRM1OPRD1
SCHEMBL9018453 0.89 HSD17B10 (0.48) LMNAALDH1A1POLBCYP2C9CYP2C19

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