SCHEMBL6561650

SCHEMBL6561650

COc1ccc(S(=O)(=O)Nc2ccccc2NC(=O)c2cnoc2C)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 2/20 0.53
LMNA P02545 7/20 0.53
SMN1; SMN2 Q16637 5/20 0.53
ALDH1A1 P00352 5/20 0.53
HTT P42858 2/20 0.53
TP53 P04637 2/20 0.53
HPGD P15428 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
MAPT P10636 4/20 0.51
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
NPC1 O15118 2/20 0.50
POLB P06746 2/20 0.50
MAPK1 P28482 2/20 0.50
KDM4E B2RXH2 1/20 0.50
RECQL P46063 1/20 0.50
TUBB4A P04350 1/20 0.49
TUBB P07437 1/20 0.49
TUBA3C P0DPH7 1/20 0.49

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
SCHEMBL6562125 0.89 LMNA (0.60) KEAP1LMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL6561793 0.89 RAB9A (0.51) LMNASMN1; SMN2ALDH1A1HTTTP53
SCHEMBL6563618 0.87 ALDH1A1 (0.53) LMNASMN1; SMN2ALDH1A1HTTHPGD
SCHEMBL6562093 0.87 SMN1; SMN2 (0.54) KEAP1LMNASMN1; SMN2ALDH1A1HTT
SCHEMBL6561743 0.87 LMNA (0.53) KEAP1LMNASMN1; SMN2ALDH1A1HTT
SCHEMBL6563639 0.84 MEN1 (0.47) LMNASMN1; SMN2ALDH1A1HTTHPGD
SCHEMBL8627655 0.82 KEAP1 (0.67) KEAP1LMNASMN1; SMN2ALDH1A1HTT
SCHEMBL8623537 0.81 KEAP1 (0.56) KEAP1LMNASMN1; SMN2ALDH1A1HTT
SCHEMBL8626192 0.81 KEAP1 (0.56) KEAP1LMNASMN1; SMN2ALDH1A1HTT
SCHEMBL6562122 0.81 ALOX15 (0.54) KEAP1LMNASMN1; SMN2ALDH1A1HTT

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