SCHEMBL10127042

SCHEMBL10127042

Bc1ccc2nc(C)cc(C(=O)N/N=C/c3cc(Cl)cc(Cl)c3O)c2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.61
KDM4E B2RXH2 7/20 0.61
L3MBTL1 Q9Y468 6/20 0.61
KMT2A Q03164 6/20 0.61
MEN1 O00255 5/20 0.61
HTT P42858 4/20 0.61
LMNA P02545 3/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
PIK3CG P48736 1/20 0.58
TDP1 Q9NUW8 5/20 0.53
NPC1 O15118 4/20 0.53
USP2 O75604 1/20 0.53
MCOLN3 Q8TDD5 1/20 0.53
KDM1A O60341 1/20 0.47
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.44
MAPK1 P28482 1/20 0.43

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
SCHEMBL10145127 0.88 KDM4E (0.61) MAPTKDM4EL3MBTL1KMT2AMEN1
SCHEMBL684773 0.74 PIK3CG (0.69) MAPTKDM4EL3MBTL1KMT2AMEN1
SCHEMBL684495 0.74 PIK3CG (0.72) MAPTKDM4EL3MBTL1KMT2AMEN1
SCHEMBL683844 0.73 PIK3CG (0.83) MAPTKDM4EL3MBTL1KMT2AMEN1
SCHEMBL683923 0.73 PIK3CG (1.00) MAPTKDM4EL3MBTL1KMT2AMEN1
SCHEMBL685169 0.73 PIK3CG (0.68) MAPTKDM4EL3MBTL1KMT2AMEN1
SCHEMBL684735 0.73 PIK3CG (0.83) MAPTKDM4EL3MBTL1KMT2AMEN1
SCHEMBL683723 0.73 PIK3CG (0.79) MAPTKDM4EL3MBTL1KMT2AMEN1
SCHEMBL685177 0.73 PIK3CG (0.67) MAPTKDM4EL3MBTL1KMT2AMEN1
SCHEMBL684496 0.73 PIK3CG (0.67) MAPTKDM4EL3MBTL1KMT2AMEN1

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-2012024483-A1 SYNERGISTIC FUNGICIDAL AND ALGICIDAL COMPOSITIONS INCLUDING 2-HYDROXYPHENYLALDEHYDE AND 2-HYDROXYPHENYLKETONE HETEROCYCLOYLHYDRAZONES AND COPPER DOW AGROSCIENCES LLC (US) 2012-02-23 WO disclosed