SCHEMBL9538378

SCHEMBL9538378

CC(=O)c1ccc([N+](=O)[O-])c(Sc2ccccc2Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 3/20 0.59
MAPT P10636 3/20 0.58
POLB P06746 2/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
PDE7A Q13946 7/20 0.55
LMNA P02545 2/20 0.52
ALDH1A1 P00352 2/20 0.52
RAB9A P51151 1/20 0.52
PDE7B Q9NP56 1/20 0.50
USP47 Q96K76 2/20 0.48
ITGB2 P05107 1/20 0.47
ICAM1 P05362 1/20 0.47
ITGAL P20701 1/20 0.47
KMT2A Q03164 3/20 0.47
ATM Q13315 1/20 0.47
MEN1 O00255 2/20 0.46
SLC6A4 P31645 2/20 0.46
MITF O75030 1/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL9535431 0.86 USP7 (0.60) USP7MAPTPOLBL3MBTL1PDE7A
SCHEMBL9537086 0.82 MAPT (0.80) MAPTPOLBL3MBTL1PDE7AALDH1A1
SCHEMBL9535501 0.82 MAPT (0.56) MAPTPOLBL3MBTL1PDE7ALMNA
SCHEMBL9534662 0.81 MAPT (0.55) USP7MAPTPOLBL3MBTL1PDE7A
SCHEMBL9537682 0.80 MAPT (0.60) USP7MAPTPOLBL3MBTL1PDE7A
SCHEMBL5830744 0.80 MAPT (0.48) USP7MAPTPOLBL3MBTL1PDE7A
SCHEMBL9535335 0.78 MAPT (0.53) USP7MAPTPOLBL3MBTL1PDE7A
SCHEMBL11548274 0.77 ALDH1A1 (0.52) MAPTPOLBL3MBTL1PDE7ALMNA
SCHEMBL9538024 0.77 PDE7A (0.65) MAPTPOLBL3MBTL1PDE7AALDH1A1
SCHEMBL340544 0.77 MAPT (0.58) MAPTPOLBL3MBTL1PDE7ALMNA

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