SCHEMBL8302489

SCHEMBL8302489

COc1nn(C)cc1-n1nn[nH]c1=O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
PAX8 Q06710 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
SCHEMBL8307265 0.81 ADORA2A (0.32)
SCHEMBL8303900 0.80 MAPT (0.36) NPC1RAB9A
SCHEMBL8303635 0.75 PRMT5 (0.37)
SCHEMBL8308150 0.73 NFE2L2 (0.32) NFE2L2
SCHEMBL8302418 0.72 KDM4E (0.33) NPC1RAB9A
SCHEMBL8686576 0.72 BTK (0.43) NPC1RAB9A
SCHEMBL8308632 0.70
SCHEMBL8599986 0.70 ALDH1A1 (0.37) NFE2L2NPC1RAB9A
SCHEMBL8302516 0.70 PRMT5 (0.36) NFE2L2
SCHEMBL5906062 0.69 MGLL (0.47)

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