SCHEMBL8307345

SCHEMBL8307345

COc1csc(C)c1-n1nn[nH]c1=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.32
NFE2L2 Q16236 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
SCHEMBL8308484 0.79
SCHEMBL8309051 0.72 KEAP1 (0.33) CYP2C9NFE2L2
SCHEMBL8306783 0.70
SCHEMBL8307466 0.70
SCHEMBL12114356 0.70 MAPK11 (0.37)
SCHEMBL8599986 0.69 ALDH1A1 (0.37) NFE2L2
SCHEMBL8309718 0.68
SCHEMBL5906062 0.68 MGLL (0.47)
SCHEMBL17950844 0.68 KMT2A (0.43) CYP2C9
SCHEMBL17946008 0.68 CYP2C9 (0.40) CYP2C9NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0666857-B1 METHOD FOR PREPARING TAXANE DERIVATIVES RHONE POULENC RORER SA (FR) 1999-05-19 EP disclosed
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