SCHEMBL7870547

SCHEMBL7870547

O=C(NCCO)Oc1ccc(C(=O)NS(=O)(=O)c2cccc(C(=O)NC3CCCCC3)c2)cn1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.48
HSD17B10 Q99714 2/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD11B1 P28845 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
SCHEMBL7862847 0.92 ALDH1A1 (0.47) HTTHSD17B10ALDH1A1GAAKMT2A
SCHEMBL7867896 0.90 LMNA (0.49) HTTALDH1A1GAAKMT2A
SCHEMBL8869693 0.87 HSD17B10 (0.50) HTTHSD17B10ALDH1A1GAAKMT2A
SCHEMBL9018263 0.86 HTT (0.51) HTTHSD17B10ALDH1A1GAAKMT2A
SCHEMBL7874547 0.85 SMN1; SMN2 (0.43) HTTHSD17B10KMT2A
SCHEMBL7862681 0.83 HSD17B10 (0.43) HTTHSD17B10KMT2A
SCHEMBL9018178 0.83 ALDH1A1 (0.49) HTTHSD17B10ALDH1A1GAAKMT2A
SCHEMBL9018476 0.83 HTT (0.50) HTTHSD17B10ALDH1A1GAAKMT2A
SCHEMBL7867890 0.83 POLB (0.40) ALDH1A1GAAKMT2A
SCHEMBL7871628 0.83 HTT (0.53) HTTHSD17B10ALDH1A1GAA

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-0562512-B1 Sulfonamidocarbonylpyridine-2-carboxamides and their use as medicines HOECHST AG (DE) 2001-02-21 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