SCHEMBL9515950

SCHEMBL9515950

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

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 1/20 0.40
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
KMT2A Q03164 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 3/20 0.38
PTPN1 P18031 1/20 0.38
P4HTM Q9NXG6 5/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
EGLN1 Q9GZT9 1/20 0.35
SCN9A Q15858 3/20 0.34
SCN5A Q14524 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.33

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
SCHEMBL9516030 0.92 GABRA5 (0.44) GABRA5RAB9ANPC1KMT2AL3MBTL1
SCHEMBL9517187 0.92 NPC1 (0.40) GABRA5RAB9ANPC1KMT2AL3MBTL1
SCHEMBL9517984 0.86 GABRA5 (0.42) GABRA5RAB9ANPC1KMT2AL3MBTL1
SCHEMBL9517031 0.86 P4HTM (0.39) GABRA5RAB9ANPC1KMT2AL3MBTL1
SCHEMBL9516300 0.86 GABRA5 (0.48) GABRA5RAB9ANPC1KMT2AL3MBTL1
SCHEMBL9518142 0.85 P4HTM (0.47) GABRA5RAB9ANPC1KMT2AL3MBTL1
SCHEMBL9516086 0.84 GABRA5 (0.41) GABRA5RAB9ANPC1KMT2AL3MBTL1
SCHEMBL9517019 0.82 GABRA5 (0.40) GABRA5RAB9ANPC1HPGDP4HTM
SCHEMBL9516888 0.81 GABRA5 (0.50) GABRA5HPGDPTPN1P4HTMSMN1; SMN2
SCHEMBL9517918 0.80 GABRA5 (0.43) GABRA5HPGDPTPN1P4HTMSMN1; 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