SCHEMBL8308742

SCHEMBL8308742

O=c1[nH]nnn1-c1ccco1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.35
APAF1 O14727 1/20 0.35
NPC1 O15118 1/20 0.35
NSD2 O96028 1/20 0.35
RAB9A P51151 1/20 0.35
CACNA1B Q00975 1/20 0.35
APBA1 Q02410 1/20 0.35
SAE1 Q9UBE0 1/20 0.35
UBA2 Q9UBT2 1/20 0.35
CHEK1 O14757 3/20 0.35
ADORA3 P0DMS8 2/20 0.34
LMNA P02545 2/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
ALPL P05186 1/20 0.33
KDM4E B2RXH2 4/20 0.32
HSD17B10 Q99714 2/20 0.32
ADORA2A P29274 2/20 0.31
ADORA1 P30542 2/20 0.31
MEN1 O00255 2/20 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
SCHEMBL8303598 0.71
SCHEMBL8307256 0.71
SCHEMBL4672478 0.69 GAA (0.43) NPC1RAB9ACACNA1BAPBA1ADORA3
SCHEMBL8308718 0.69
SCHEMBL8306679 0.69
SCHEMBL8305979 0.69 KDM4E (0.34) LMNAKDM4EHPGDTDP1
SCHEMBL8304017 0.69 GAA (0.34) CHEK1
SCHEMBL8306953 0.68 KDM5B (0.31) CHEK1
SCHEMBL8307354 0.68 ALDH1A1 (0.30) ALDH1A1
SCHEMBL8307422 0.66 MEN1 (0.33) LMNAKDM4EMEN1ALDH1A1HPGD

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