SCHEMBL9535502

SCHEMBL9535502

CC(=O)c1ccc(N)c(Sc2ccc(F)cc2F)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
USP7 Q93009 2/20 0.43
USP10 Q14694 1/20 0.43
USP47 Q96K76 1/20 0.43
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
MAOB P27338 1/20 0.41
HDAC1 Q13547 3/20 0.39
HDAC3 O15379 1/20 0.39
HDAC2 Q92769 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
PRKCI P41743 1/20 0.39
MAPK14 Q16539 8/20 0.38
KEAP1 Q14145 1/20 0.38
PTGS2 P35354 1/20 0.37

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
SCHEMBL9535068 0.90 MAPT (0.52) MAPTPOLBL3MBTL1USP7USP10
SCHEMBL9534376 0.87 MAPK14 (0.46) MAPTALDH1A1KDM4EHPGDHDAC1
SCHEMBL9535727 0.85 ALDH1A1 (0.40) MAPTUSP7USP10USP47ALDH1A1
SCHEMBL9538792 0.85 MAPT (0.40) MAPTUSP7USP10USP47ALDH1A1
SCHEMBL9537015 0.85 MAPK14 (0.48) MAPTALDH1A1KDM4EHPGDHDAC1
SCHEMBL9538516 0.82 MAPT (0.45) MAPTPOLBALDH1A1KDM4EHPGD
SCHEMBL9536752 0.82 ALDH1A1 (0.43) MAPTALDH1A1KDM4EHPGDHDAC1
SCHEMBL9535539 0.82 MAPK14 (0.42) MAPTALDH1A1KDM4EHPGDHDAC1
SCHEMBL9536872 0.80 USP7 (0.41) MAPTUSP7USP10USP47ALDH1A1
Diethylamine SCHEMBL9537391 0.79 MAPK14 (0.41) MAPTALDH1A1KDM4EHPGDHDAC1

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-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
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