SCHEMBL7747557

SCHEMBL7747557

N=C(N)N/N=C/c1ccc(O)cc1O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.66
KMT2A Q03164 5/20 0.66
L3MBTL1 Q9Y468 3/20 0.66
ALPL P05186 1/20 0.66
POLB P06746 1/20 0.66
ALPI P09923 1/20 0.66
ALPG P10696 1/20 0.66
EIF4H Q15056 1/20 0.66
NTRK1 P04629 1/20 0.55
NPC1 O15118 4/20 0.54
RAB9A P51151 3/20 0.54
BCHE P06276 1/20 0.51
SIRT1 Q96EB6 1/20 0.51
KDM4E B2RXH2 5/20 0.49
MAPT P10636 4/20 0.49
GAA P10253 3/20 0.49
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HTT P42858 3/20 0.48

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
SCHEMBL7747561 1.00 MEN1 (0.66) MEN1KMT2AL3MBTL1ALPLPOLB
SCHEMBL6743215 0.87 KMT2A (0.51) MEN1KMT2AL3MBTL1ALPLPOLB
SCHEMBL6743212 0.87 KMT2A (0.51) MEN1KMT2AL3MBTL1ALPLPOLB
SCHEMBL19449624 0.86 MEN1 (0.70) MEN1KMT2AL3MBTL1ALPLPOLB
Hydrochloric Acid SCHEMBL17560846 0.85 MEN1 (0.68) MEN1KMT2AL3MBTL1ALPLPOLB
SCHEMBL31105659 0.84 TTR (0.49) MEN1KMT2AL3MBTL1ALPLPOLB
SCHEMBL23996048 0.83 MEN1 (0.66) MEN1KMT2AL3MBTL1ALPLPOLB
SCHEMBL13641767 0.83 L3MBTL1 (0.66) MEN1KMT2AL3MBTL1ALPLPOLB
SCHEMBL6740122 0.83 ADORA2A (0.57) MEN1KMT2AL3MBTL1ALPLPOLB
SCHEMBL6740126 0.83 ADORA2A (0.57) MEN1KMT2AL3MBTL1ALPLPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001025192-A1 GUANIDINE DERIVATIVES AND THEIR USE IN THE PRODUCTION OF A MEDICAMENT FOR BLOCKING XANTHINE OXIDASE/DEHYDROGENASE MELACURE THERAPEUTICS AB (SE) 2001-04-12 WO claimed