SCHEMBL6561743

SCHEMBL6561743

CCc1oncc1C(=O)Nc1ccccc1NS(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.53
ALDH1A1 P00352 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
HTT P42858 2/20 0.53
TP53 P04637 1/20 0.53
HPGD P15428 1/20 0.53
KCNA5 P22460 1/20 0.49
HDAC3 O15379 3/20 0.48
HDAC1 Q13547 3/20 0.48
NCOR2 Q9Y618 3/20 0.48
HDAC2 Q92769 2/20 0.48
KEAP1 Q14145 2/20 0.47
TUBB4A P04350 1/20 0.47
TUBB P07437 1/20 0.47
TUBA3C P0DPH7 1/20 0.47
TUBA1B P68363 1/20 0.47
TUBA4A P68366 1/20 0.47
TUBB4B P68371 1/20 0.47
TUBB3 Q13509 1/20 0.47

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
SCHEMBL6561650 0.87 KEAP1 (0.53) LMNAALDH1A1SMN1; SMN2L3MBTL1HTT
SCHEMBL6563164 0.81 ALDH1A1 (0.54) LMNAALDH1A1SMN1; SMN2L3MBTL1HTT
SCHEMBL6561679 0.81 ALDH1A1 (0.49) LMNAALDH1A1SMN1; SMN2L3MBTL1HTT
SCHEMBL8627655 0.77 KEAP1 (0.67) LMNAALDH1A1SMN1; SMN2L3MBTL1HTT
SCHEMBL6563185 0.77 TDP1 (0.53) LMNAALDH1A1SMN1; SMN2L3MBTL1HTT
SCHEMBL8623537 0.76 KEAP1 (0.56) LMNAALDH1A1SMN1; SMN2L3MBTL1HTT
SCHEMBL8626192 0.76 KEAP1 (0.56) LMNAALDH1A1SMN1; SMN2L3MBTL1HTT
SCHEMBL8627646 0.76 POLB (0.71) LMNAALDH1A1SMN1; SMN2L3MBTL1HTT
SCHEMBL8624229 0.76 LMNA (0.70) LMNAALDH1A1SMN1; SMN2L3MBTL1HTT
SCHEMBL8622964 0.76 LMNA (0.57) LMNAALDH1A1SMN1; SMN2L3MBTL1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0990645-B1 NOVEL SULFONAMIDE DERIVATIVES NIPPON KAYAKU KK (JP) 2004-07-28 EP disclosed
US-6180796-B1 TUBULIN POLYMERIZATION INHIBITORS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2001-01-30 US disclosed
EP-0990645-A1 NOVEL SULFONAMIDE DERIVATIVES Nippon Kayaku Kabushiki Kaisha (JP) 2000-04-05 EP disclosed