SCHEMBL5608967

SCHEMBL5608967

O=C1[N]Nc2cc(Cc3ccc(F)cc3)c([N+](=O)[O-])cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.39
MAPT P10636 3/20 0.37
LMNA P02545 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
RET P07949 1/20 0.34
KDR P35968 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
ALDH1A1 P00352 2/20 0.33
HTT P42858 1/20 0.33
DAO P14920 1/20 0.33
TXNRD1 Q16881 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
MDM2 Q00987 1/20 0.32

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
SCHEMBL5608745 0.88 SNCA (0.40) SNCAMAPTATMTDP1ALDH1A1
SCHEMBL5608587 0.88 SNCA (0.39) SNCAMAPTLMNAL3MBTL1KMT2A
SCHEMBL5608922 0.88 MAOA (0.40) SNCAL3MBTL1KMT2AMEN1NPC1
SCHEMBL5609575 0.80 MAPT (0.40) MAPTLMNAKMT2ARETKDR
SCHEMBL5618439 0.80 MAPT (0.40) MAPTLMNARETKDRALDH1A1
SCHEMBL5608541 0.77 MAPT (0.40) MAPTLMNAKMT2ARETKDR
SCHEMBL5608461 0.74 GABRA1 (0.34) SNCAMAPTL3MBTL1KMT2AMEN1
SCHEMBL5608778 0.74 ALOX15 (0.41) SNCAALDH1A1
SCHEMBL5608736 0.70 TSHR (0.40) LMNAALDH1A1
SCHEMBL22897910 0.68 TSHR (0.50) SNCAMAPTLMNAL3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1797042-A1 INDOZOLONE DERIVATIVES AS 11B-HSD1 INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2007-06-20 EP disclosed
WO-2006034804-A1 INDOZOLONE DERIVATIVES AS 11B-HSD1 INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2006-04-06 WO disclosed