SCHEMBL11568673

SCHEMBL11568673

O=[N+]([O-])Nc1ccccc1C(Cl)(Cl)Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.35
MAPK1 P28482 5/20 0.35
ALDH1A1 P00352 4/20 0.35
LMNA P02545 4/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
CASP7 P55210 1/20 0.34
WNK1 Q9H4A3 1/20 0.34
RORC P51449 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
PKM P14618 2/20 0.31
HPGD P15428 2/20 0.31
PHGDH O43175 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL1657403 0.81 NPSR1 (0.39) MAPK1ALDH1A1LMNAL3MBTL1HTT
SCHEMBL1768919 0.81 POLB (0.50) MAPTMAPK1ALDH1A1L3MBTL1TDP1
SCHEMBL7208909 0.78 MAPK1 (0.49) MAPTMAPK1ALDH1A1LMNAL3MBTL1
SCHEMBL31374378 0.78 MAPK1 (0.49) MAPTMAPK1ALDH1A1LMNAL3MBTL1
SCHEMBL9784429 0.73 PDK1 (0.34) ALDH1A1L3MBTL1TDP1RORCGAA
SCHEMBL309256 0.71 MEN1 (0.47) MAPTMAPK1ALDH1A1LMNAL3MBTL1
SCHEMBL45337 0.69 MAPT (0.47) MAPTMAPK1ALDH1A1LMNAL3MBTL1
SCHEMBL11045869 0.69 MEN1 (0.43) MAPTMAPK1ALDH1A1LMNAL3MBTL1
SCHEMBL2333439 0.69 HSD17B10 (0.48) MAPTALDH1A1LMNAHTTTDP1
SCHEMBL950729 0.69 MAPK1 (0.60) MAPTMAPK1ALDH1A1L3MBTL1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0003880-A1 Substituted phenylnitramines with plant growth regulating properties AMERICAN CYANAMID COMPANY (US) 1979-09-05 EP disclosed