SCHEMBL8551691

SCHEMBL8551691

CC(=O)Cn1nn[nH]c1=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MITF O75030 1/20 0.40
S1PR4 O95977 1/20 0.40
S1PR1 P21453 1/20 0.40
NFE2L2 Q16236 1/20 0.40
GAA P10253 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL7984645 0.77
SCHEMBL3172918 0.76
SCHEMBL5906372 0.72
SCHEMBL13525564 0.69
SCHEMBL8603321 0.68
SCHEMBL7603424 0.68 SLC9A1 (0.38) ALDH1A1MAPTGAA
SCHEMBL18882789 0.68 SORT1 (0.41) ALDH1A1MAPTSMN1; SMN2NFE2L2KMT2A
SCHEMBL15132811 0.68 ALDH1A1 (0.38) RAB9ANPC1ALDH1A1MAPTSMN1; SMN2
SCHEMBL8603062 0.68 NFE2L2 (0.31) NFE2L2
SCHEMBL8916963 0.67 NFE2L2 (0.33) NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1172109-A Tetrazolinones and herbicides BAYER AGROCHEM KK (JP) 1998-02-04 CN disclosed
EP-0820994-A1 Tetrazolinones as herbicides and intermediates NIHON BAYER AGROCHEM K.K. (JP) 1998-01-28 EP disclosed