SCHEMBL11409644

SCHEMBL11409644

[O-][N+](=Cc1ccccc1)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
G6PD P11413 4/20 0.66
HSD17B10 Q99714 3/20 0.48
MAPT P10636 9/20 0.47
ALDH1A1 P00352 9/20 0.47
ALOX15 P16050 2/20 0.47
TSHR P16473 1/20 0.47
RECQL P46063 1/20 0.47
NPC1 O15118 5/20 0.45
RAB9A P51151 4/20 0.41
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.38
PDE7A Q13946 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSP90AA1 P07900 1/20 0.36
NFE2L2 Q16236 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL11404341 0.86 ALDH1A1 (0.62) G6PDHSD17B10MAPTALDH1A1ALOX15
SCHEMBL11406439 0.85 G6PD (0.60) G6PDHSD17B10MAPTALDH1A1ALOX15
SCHEMBL11406270 0.85 G6PD (0.60) G6PDHSD17B10MAPTALDH1A1ALOX15
SCHEMBL11411219 0.84 G6PD (0.62) G6PDHSD17B10MAPTALDH1A1ALOX15
SCHEMBL11409587 0.82 ALDH1A1 (0.56) G6PDHSD17B10MAPTALDH1A1ALOX15
SCHEMBL12355268 0.79 G6PD (1.00) G6PDHSD17B10MAPTALDH1A1ALOX15
SCHEMBL2240392 0.79 G6PD (1.00) G6PDHSD17B10MAPTALDH1A1ALOX15
SCHEMBL12355312 0.79 G6PD (0.66) G6PDMAPTALDH1A1ALOX15TSHR
SCHEMBL12416920 0.79 HSD17B10 (0.48) G6PDHSD17B10MAPTALDH1A1TSHR
SCHEMBL2242752 0.79 G6PD (0.66) G6PDMAPTALDH1A1ALOX15TSHR

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
US-4224340-A Anti-inflammatory compositions containing α-phenyl-N-phenylnitrone compounds WILLIAM H. RORER, INC. (US) 1980-09-23 US disclosed
US-4214003-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1980-07-22 US disclosed
US-4197314-A WITH A DIPHENYL NITRONE WILLIAM H. RORER, INC. (US) 1980-04-08 US disclosed
US-4153722-A ANTIINFLAMMATORY, A-PHENYL-N-PHENYLNITRONE WILLIAM H. RORER, INC. (US) 1979-05-08 US disclosed