SCHEMBL8740326

SCHEMBL8740326

CCc1ccc2nc3ccccc3nc2c1OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 10/20 0.61
MAPT P10636 6/20 0.49
RAB9A P51151 5/20 0.49
NPC1 O15118 3/20 0.49
KDM4E B2RXH2 2/20 0.49
THRB P10828 2/20 0.49
BLM P54132 2/20 0.49
GAA P10253 2/20 0.49
MAPK1 P28482 1/20 0.49
ATM Q13315 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
POLB P06746 4/20 0.46
KMT2A Q03164 6/20 0.43
ALDH1A1 P00352 6/20 0.43
MEN1 O00255 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 2/20 0.43
CASP6 P55212 1/20 0.42
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39

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
SCHEMBL8585680 0.87 NQO2 (0.48) NQO2MAPTRAB9ANPC1KDM4E
SCHEMBL29572798 0.83 NQO2 (0.54) NQO2MAPTRAB9ANPC1KDM4E
SCHEMBL7894193 0.77 NQO2 (0.42) NQO2MAPTRAB9ANPC1KDM4E
SCHEMBL7755602 0.77 NQO2 (0.67) NQO2MAPTRAB9ANPC1KDM4E
Hydrochloric Acid SCHEMBL28861787 0.76 NQO2 (0.41) NQO2MAPTRAB9ANPC1KDM4E
SCHEMBL18387433 0.76 NQO2 (0.65) NQO2MAPTRAB9ANPC1KDM4E
Hydrochloric Acid SCHEMBL28730612 0.75 NQO2 (0.40) NQO2MAPTRAB9ANPC1KDM4E
SCHEMBL3414003 0.74 NQO2 (0.50) NQO2MAPTRAB9ANPC1KDM4E
Sulfuric Acid SCHEMBL29166969 0.73 NQO2 (0.56) NQO2MAPTRAB9ANPC1KDM4E
Hydrochloric Acid SCHEMBL6769346 0.73 NQO2 (0.48) NQO2MAPTRAB9ANPC1KDM4E

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-0606296-A4 REAGENTS AND ASSAY METHODS INCLUDING A PHENAZINE-CONTAINING INDICATOR. BOEHRINGER MANNHEIM CORP (US) 1997-02-05 EP disclosed
EP-0606296-A1 REAGENTS AND ASSAY METHODS INCLUDING A PHENAZINE-CONTAINING INDICATOR BOEHRINGER MANNHEIM CORPORATION (US) 1994-07-20 EP disclosed
WO-1993006487-A1 REAGENTS AND ASSAY METHODS INCLUDING A PHENAZINE-CONTAINING INDICATOR BOEHRINGER MANNHEIM CORPORATION (US) 1993-04-01 WO disclosed