SCHEMBL8302340

SCHEMBL8302340

Cc1nn(C)c(C)c1-n1nn[nH]c1=O

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
TP53 P04637 1/20 0.33
THRB P10828 1/20 0.33
TLR9 Q9NR96 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
RGS12 O14924 1/20 0.33
USP2 O75604 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
CASP3 P42574 1/20 0.32
ALDH1A1 P00352 3/20 0.31
GAA P10253 2/20 0.31
KDM4E B2RXH2 1/20 0.31
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 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
SCHEMBL8306665 0.83 L3MBTL1 (0.33) L3MBTL1KDM4E
SCHEMBL8304992 0.81 NFE2L2 (0.32)
SCHEMBL8307838 0.81
SCHEMBL8308478 0.73 POLB (0.32) LMNATHRBMAPTALDH1A1GAA
SCHEMBL8304232 0.73 KDM4E (0.37) LMNAKMT2AALDH1A1KDM4E
SCHEMBL8304600 0.71 POLB (0.49) LMNAL3MBTL1MEN1MAPTKMT2A
SCHEMBL8306156 0.71
SCHEMBL8307507 0.71 PRMT5 (0.33) ALDH1A1GAAKDM4EPRMT5WDR77
SCHEMBL8306783 0.69
SCHEMBL8307157 0.69 BRD4 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0695748-B1 Tetrazolinone herbicides BAYER AGROCHEM KK (JP) 1999-05-06 EP disclosed
US-5589439-A HERBICIDES NIHON BAYER AGROCHEM K.K. (JP) 1996-12-31 US disclosed
EP-0695748-A1 Tetrazolinone herbicides NIHON BAYER AGROCHEM K.K. (JP) 1996-02-07 EP disclosed