SCHEMBL7704876

SCHEMBL7704876

COc1ccc(CN2CCN(S(=O)(=O)c3ccc(CNC(=O)c4ccc(Cl)cc4)s3)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
LMNA P02545 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
POLB P06746 2/20 0.57
MAPK1 P28482 1/20 0.57
TSHR P16473 1/20 0.56
MAPK9 P45984 1/20 0.52
MAPK10 P53779 1/20 0.52
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
KDM4E B2RXH2 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
BCL2 P10415 1/20 0.48
BCL2L1 Q07817 1/20 0.48
GAA P10253 1/20 0.47
PKM P14618 1/20 0.47
HIF1A Q16665 1/20 0.46
EPAS1 Q99814 1/20 0.46
DRD4 P21917 1/20 0.46

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
SCHEMBL2426839 0.88 MEN1 (0.53) ALDH1A1LMNASMN1; SMN2POLBMAPK1
SCHEMBL3480113 0.88 MAPK9 (0.54) ALDH1A1LMNASMN1; SMN2POLBMAPK1
SCHEMBL3480648 0.88 MAPK9 (0.60) ALDH1A1LMNASMN1; SMN2MAPK1MAPK9
SCHEMBL2421342 0.86 MAPK9 (0.56) ALDH1A1LMNASMN1; SMN2POLBMAPK1
SCHEMBL2426378 0.85 MAPK9 (0.53) ALDH1A1LMNASMN1; SMN2POLBTSHR
SCHEMBL7434542 0.84 DRD2 (0.58) LMNASMN1; SMN2POLBMAPK1TSHR
SCHEMBL7894066 0.83 MAPK9 (0.51) ALDH1A1SMN1; SMN2POLBTSHRMAPK9
SCHEMBL6431959 0.83 MAPK9 (0.55) ALDH1A1LMNASMN1; SMN2MAPK1MAPK9
SCHEMBL2421105 0.82 MAPK9 (0.53) ALDH1A1LMNAPOLBTSHRMAPK9
SCHEMBL7439629 0.81 MAPK9 (0.51) ALDH1A1LMNASMN1; SMN2MAPK1MAPK9

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-1193268-A1 Pharmaceutically active sulfonamide derivatives bearing both lipophilic and ionisable moieties as inhibitors of protein Junkinases Applied Research Systems ARS Holding N.V. (AN) 2002-04-03 EP claimed
EP-1193268-A1 Pharmaceutically active sulfonamide derivatives bearing both lipophilic and ionisable moieties as inhibitors of protein Junkinases Applied Research Systems ARS Holding N.V. (AN) 2002-04-03 EP disclosed