SCHEMBL8304709

SCHEMBL8304709

Cc1csc(-n2nn[nH]c2=O)n1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
EP300 Q09472 1/20 0.39
KAT2A Q92830 1/20 0.39
KAT2B Q92831 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.34
RAB9A P51151 2/20 0.33
NOS1 P29475 1/20 0.33
OXTR P30559 1/20 0.33
NPC1 O15118 1/20 0.33
MAT2A P31153 1/20 0.33
DPP4 P27487 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.30

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
SCHEMBL8306756 0.73 PNP (0.39) RAB9ANPC1MAPTIRAK4
SCHEMBL8303401 0.70 KDM4E (0.31) SMN1; SMN2KDM4EALDH1A1
SCHEMBL8307380 0.69 TDP1 (0.40) L3MBTL1EP300KAT2AKAT2BSMN1; SMN2
SCHEMBL8304805 0.68
SCHEMBL8308484 0.68
SCHEMBL8307466 0.68
SCHEMBL8303549 0.67
SCHEMBL8302524 0.67
SCHEMBL8305940 0.67 DPP4 (0.31) DPP4
SCHEMBL8686370 0.67 KDM4E (0.31) NOS1KDM4E

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