SCHEMBL8740325

SCHEMBL8740325

CCCOc1cccc2nc3ccccc3nc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 6/20 0.61
MCHR1 Q99705 4/20 0.54
TLR8 Q9NR97 3/20 0.50
MAPT P10636 5/20 0.46
RAB9A P51151 5/20 0.46
POLB P06746 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 2/20 0.46
THRB P10828 2/20 0.46
BLM P54132 2/20 0.46
MEN1 O00255 1/20 0.46
CASP6 P55212 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPC1 O15118 2/20 0.46
LMNA P02545 1/20 0.46
G6PD P11413 1/20 0.46
PKM P14618 1/20 0.46
GAA P10253 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL8585681 0.85 NQO2 (0.46) NQO2MCHR1TLR8MAPTRAB9A
SCHEMBL12377711 0.83 NQO2 (0.62) NQO2MCHR1MAPTRAB9APOLB
SCHEMBL3724125 0.79 NQO2 (0.59) NQO2MAPTRAB9APOLBALDH1A1
SCHEMBL9999559 0.79 NQO2 (0.59) NQO2MAPTRAB9APOLBALDH1A1
SCHEMBL12377687 0.77 CYSLTR2 (0.52) NQO2MAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL12377707 0.76 NQO2 (0.49) NQO2MCHR1MAPTRAB9APOLB
SCHEMBL23181356 0.76 NQO2 (0.56) NQO2MAPTRAB9APOLBALDH1A1
Alcohol SCHEMBL27785418 0.76 NQO2 (0.83) NQO2MAPTRAB9APOLBALDH1A1
SCHEMBL1513023 0.76 NQO2 (1.00) NQO2MCHR1MAPTRAB9APOLB
SCHEMBL2291623 0.75 NQO2 (0.70) NQO2MAPTRAB9APOLBALDH1A1

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