SCHEMBL9018005

SCHEMBL9018005

COC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2cccc3cccnc23)cn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.53
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ POLB P06746 2/20 0.49
▸ P4HTM Q9NXG6 1/20 0.46
▸ TP53 P04637 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ MAPT P10636 2/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ GAA P10253 3/20 0.44
▸ LMNA P02545 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ PPARG P37231 1/20 0.43
▸ SLC40A1 Q9NP59 1/20 0.43

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
SCHEMBL9574747 0.86 POLB (0.56) ALDH1A1MEN1KMT2APOLBP4HTM
SCHEMBL9018333 0.85 P4HTM (0.64) MEN1KMT2APOLBP4HTMTSHR
SCHEMBL9018396 0.83 ALDH1A1 (0.61) ALDH1A1MEN1KMT2APOLBP4HTM
SCHEMBL9018490 0.79 P4HTM (0.71) ALDH1A1MEN1KMT2AP4HTMMAPT
SCHEMBL9018103 0.79 P4HTM (0.45) P4HTM
SCHEMBL8869007 0.78 POLB (0.59) ALDH1A1MEN1KMT2APOLBP4HTM
SCHEMBL7870518 0.78 P4HTM (0.64) MEN1KMT2AP4HTMLMNA
SCHEMBL9018437 0.76 P4HTM (0.57) P4HTM
SCHEMBL9018353 0.76 P4HTM (0.60) ALDH1A1POLBP4HTMTSHR
SCHEMBL9018246 0.75 P4HTM (0.57) POLBP4HTMTSHRPPARG

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-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 claimed
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 claimed
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
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