SCHEMBL11066138

SCHEMBL11066138

O=C1C(=NO)N(O)N1c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPK1 P28482 1/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ GSK3A P49840 2/20 0.35
▸ GSK3B P49841 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ MGLL Q99685 1/20 0.34
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ SCN2A Q99250 1/20 0.34
▸ LMNA P02545 2/20 0.34
▸ ALOX5 P09917 1/20 0.34
▸ ABCB11 O95342 1/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ GAA P10253 1/20 0.33

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
SCHEMBL9438695 0.64 MGLL (0.42) ALDH1A1MAPK1KMT2AGSK3AGSK3B
SCHEMBL3074759 0.64 MGLL (0.43) ALDH1A1KMT2AMEN1MGLLCA9
SCHEMBL21387159 0.63 MGLL (0.41) ALDH1A1MAPK1KMT2AGSK3AGSK3B
SCHEMBL2714721 0.63 MGLL (0.41) ALDH1A1MAPK1KMT2AGSK3AGSK3B
SCHEMBL13716111 0.63 NR1H4 (0.44) ALDH1A1MAPK1KMT2AGSK3AGSK3B
SCHEMBL12220387 0.63 ALDH1A1 (0.53) KDM4EALDH1A1MAPK1KMT2AGSK3A
SCHEMBL11639145 0.61 LMNA (0.55) ALDH1A1MAPK1KMT2AGSK3AGSK3B
SCHEMBL5306506 0.60 MAPK1 (0.71) KDM4EALDH1A1MAPK1KMT2AGSK3A
SCHEMBL16280099 0.60 MGLL (0.62) ALDH1A1KMT2AMEN1MGLLCA12
SCHEMBL13841771 0.60 NR1H4 (0.45) KDM4EALDH1A1MAPK1KMT2AGSK3A

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-0087048-B1 SUBSTITUTED OXIMINOACETANILIDES, METHOD FOR THEIR PREPARATION AS WELL AS THEIR USE AS PESTICIDES BAYER AG (DE) 1985-04-17 — — EP claimed
Send feedback