SCHEMBL11274397

SCHEMBL11274397

O=[N+]([O-])c1cnccc1Oc1ccccc1Cl

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.69
MAPK1 P28482 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
HSP90AA1 P07900 1/20 0.51
GAA P10253 1/20 0.49
PTGS1 P23219 2/20 0.48
PTGS2 P35354 2/20 0.48
ALDH1A1 P00352 5/20 0.47
HTT P42858 4/20 0.47
LMNA P02545 3/20 0.47
ATM Q13315 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
PIN1 Q13526 3/20 0.42

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
SCHEMBL16295419 0.83 MAPT (0.54) HPGDMAPK1L3MBTL1MEN1KMT2A
SCHEMBL16295605 0.83 HPGD (0.47) HPGDMAPK1GAALMNASMN1; SMN2
SCHEMBL16295426 0.83 SLC6A2 (0.52) HPGDMAPK1HSP90AA1PTGS1PTGS2
SCHEMBL9266291 0.82 HPGD (1.00) HPGDMAPK1L3MBTL1MEN1KMT2A
SCHEMBL3597295 0.82 HSPB1 (0.59) HPGDL3MBTL1MEN1KMT2AGAA
SCHEMBL9853797 0.80 ALDH1A1 (0.51) MEN1KMT2AGAAPTGS1PTGS2
SCHEMBL9853600 0.80 PIN1 (0.56) HPGDMAPK1L3MBTL1MEN1KMT2A
SCHEMBL1306618 0.79 ALDH1A1 (0.46) HPGDMAPK1L3MBTL1GAAALDH1A1
SCHEMBL641398 0.78 PDE7A (0.54) HPGDMEN1KMT2AGAAPTGS1
SCHEMBL11544742 0.77 PTGS1 (0.60) HPGDMAPK1KMT2APTGS1PTGS2

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
US-4334912-A HERBICIDES WHICH ARE NONPHYTOTOXIC TO CROPS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-06-15 US disclosed