SCHEMBL9516030

SCHEMBL9516030

CCCCOCCCCS(=O)(=O)NC(=O)c1ccc(CO)nc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 1/20 0.44
PTPN1 P18031 1/20 0.41
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
RARB P10826 1/20 0.37
P4HTM Q9NXG6 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MMP1 P03956 1/20 0.36
PPARG P37231 1/20 0.36

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
SCHEMBL9517984 0.94 GABRA5 (0.42) GABRA5PTPN1MEN1NPC1RAB9A
SCHEMBL9515950 0.92 GABRA5 (0.40) GABRA5PTPN1MEN1NPC1RAB9A
SCHEMBL9516300 0.90 GABRA5 (0.48) GABRA5PTPN1MEN1NPC1RAB9A
SCHEMBL9517031 0.85 P4HTM (0.39) GABRA5PTPN1MEN1NPC1RAB9A
SCHEMBL9518142 0.84 P4HTM (0.47) GABRA5PTPN1MEN1NPC1RAB9A
SCHEMBL9517187 0.84 NPC1 (0.40) GABRA5MEN1NPC1RAB9AKMT2A
SCHEMBL9517918 0.83 GABRA5 (0.43) GABRA5PTPN1RARBP4HTMSMN1; SMN2
SCHEMBL9516131 0.83 GABRA5 (0.40) GABRA5SMN1; SMN2MMP1PPARG
SCHEMBL9517133 0.83 GABRA5 (0.42) GABRA5PTPN1RARBP4HTMSMN1; SMN2
SCHEMBL9516988 0.82 GABRA5 (0.43) GABRA5PTPN1RARBP4HTMSMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0567997-A1 4- or 5-(sulf)imido- and (sulfon)amidopyridines and their pyridine-N-oxides, process for their preparation and their use as pharmaceutical HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-03 EP disclosed