SCHEMBL9536901

SCHEMBL9536901

CC(=O)Nc1ccc(C(C)=O)cc1C(=O)c1ccc(F)cc1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 4/20 0.51
BDKRB1 P46663 1/20 0.49
SMN1; SMN2 Q16637 4/20 0.48
GAA P10253 4/20 0.48
HDAC3 O15379 1/20 0.47
HDAC2 Q92769 1/20 0.47
NCOR2 Q9Y618 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
PKM P14618 1/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
MAOB P27338 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
HTT P42858 1/20 0.42

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
SCHEMBL9538389 0.83 BDKRB1 (0.49) HDAC1BDKRB1SMN1; SMN2MAPTKDM4E
SCHEMBL9535579 0.81 GAA (0.51) HDAC1BDKRB1SMN1; SMN2GAAMAPT
SCHEMBL9539537 0.80 MAPK14 (0.47) HDAC1ALDH1A1CES2CES1MAOB
SCHEMBL29808947 0.77 HDAC1 (0.73) HDAC1SMN1; SMN2GAAHDAC3HDAC2
SCHEMBL15014104 0.77 RAB9A (0.49) HDAC1SMN1; SMN2GAAHDAC3HDAC2
SCHEMBL6106476 0.77 HDAC1 (0.73) HDAC1SMN1; SMN2GAAHDAC3HDAC2
SCHEMBL30148008 0.77 SMN1; SMN2 (0.67) HDAC1SMN1; SMN2GAAHDAC6MAPT
SCHEMBL6694651 0.77 SMN1; SMN2 (0.67) HDAC1SMN1; SMN2GAAHDAC6MAPT
SCHEMBL13291390 0.74 CES2 (0.74) L3MBTL1CES2CES1NPC1RAB9A
SCHEMBL2055287 0.74 HDAC1 (0.54) HDAC1SMN1; SMN2GAAHDAC3HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0292979-B1 NEW ALKANESULFONANILIDE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-07-21 EP disclosed
US-5034417-A Antiinflammatory agents or analgesics FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-07-23 US disclosed
CN-88103277-A Novel N-alkane sulfonyl aniline derivatives and preparation method thereof and the pharmaceutical composition that comprises this material 1988-12-07 CN disclosed
EP-0292979-A2 New alkanesulfonanilide derivatives, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-11-30 EP disclosed