SCHEMBL7425706

SCHEMBL7425706

COc1ccc(S(=O)(=O)NCc2ccncc2)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 1.00
HTT P42858 4/20 1.00
RAB9A P51151 4/20 0.79
NPC1 O15118 2/20 0.64
LMNA P02545 4/20 0.64
NR2F2 P24468 2/20 0.64
GALR3 O60755 1/20 0.64
PKM P14618 2/20 0.59
ALDH1A1 P00352 1/20 0.58
MAPK1 P28482 1/20 0.57

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
SCHEMBL17912767 0.89 SMN1; SMN2 (0.81) SMN1; SMN2HTTRAB9ANPC1LMNA
SCHEMBL7415584 0.86 SMN1; SMN2 (0.78) SMN1; SMN2HTTRAB9ALMNAPKM
SCHEMBL7425436 0.84 PKM (0.82) SMN1; SMN2HTTPKMALDH1A1
SCHEMBL7423847 0.83 SMN1; SMN2 (0.71) SMN1; SMN2HTTRAB9ALMNAPKM
SCHEMBL7428268 0.79 HTT (0.65) SMN1; SMN2HTTRAB9ALMNAPKM
SCHEMBL4182162 0.79 KMT2A (0.77) SMN1; SMN2HTTLMNAALDH1A1MAPK1
SCHEMBL7425093 0.79 PKM (0.66) SMN1; SMN2HTTRAB9APKMALDH1A1
SCHEMBL7420203 0.78 SMN1; SMN2 (0.70) SMN1; SMN2HTTRAB9ALMNAPKM
SCHEMBL17456893 0.78 SMN1; SMN2 (1.00) SMN1; SMN2HTTRAB9ANPC1LMNA
SCHEMBL7425459 0.77 GAA (0.80) SMN1; SMN2HTTLMNAALDH1A1MAPK1

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
WO-1996036595-A1 3,4-DISUBSTITUTED-PHENYLSULPHONAMIDES AND THEIR THERAPEUTIC USE CHIROSCIENCE LIMITED (GB) 1996-11-21 WO disclosed