SCHEMBL3708192

SCHEMBL3708192

O=c1c2ccccc2oc2cccc(-c3ccccn3)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.51
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 4/20 0.50
HPGD P15428 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HSD17B10 Q99714 3/20 0.50
MAPT P10636 2/20 0.50
GLA P06280 1/20 0.50
CYP3A4 P08684 1/20 0.50
PGAM1 P18669 1/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50
PDE5A O76074 1/20 0.46
CYP17A1 P05093 1/20 0.44
CYP19A1 P11511 1/20 0.44
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
AHR P35869 1/20 0.44
MGAM O43451 1/20 0.43
GAA P10253 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
SCHEMBL483552 0.87 KDM4E (0.45) MAOAALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL30022079 0.87 KDM4E (0.45) MAOAALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL24793680 0.84 MAOA (0.53) MAOAALDH1A1KDM4EHPGDSMN1; SMN2
Biphenyl SCHEMBL29177696 0.82 KDM4E (0.41) ALDH1A1KDM4EHPGDSMN1; SMN2HSD17B10
SCHEMBL28390076 0.80 MAOA (0.47) MAOAALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL4572505 0.80 MAOA (0.65) MAOAALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL24794744 0.79 MAOA (0.43) MAOAALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL28393268 0.78 MAOA (0.48) MAOAALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL28881681 0.78 MAOA (0.50) MAOAALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL483218 0.78 ALOX5 (0.50) ALDH1A1KDM4EHPGDSMN1; SMN2HSD17B10

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-2010084090-A1 PYRIDYL-AZA(THIO)XANTHONE SENSITIZER COMPRISING LANTHANIDE(III) ION COMPLEXING COMPOUNDS, THEIR LUMINESCENT LANTHANIDE (III) ION COMPLEXES AND USE THEREOF AS FLUORESCENT LABELS. CIS BIO INTERNATIONAL (FR) 2010-07-29 WO disclosed