SCHEMBL29581806

SCHEMBL29581806

c1ccc2nc3c(nc2c1)c1nc2ccccc2nc1c1nc2ccccc2nc31

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.71
ALDH1A1 P00352 4/20 0.56
GAA P10253 2/20 0.56
HPGD P15428 2/20 0.56
KDM4E B2RXH2 1/20 0.56
HSD17B10 Q99714 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
NQO2 P16083 6/20 0.55
KMT2A Q03164 3/20 0.55
RAB9A P51151 2/20 0.55
NPSR1 Q6W5P4 1/20 0.55
ACHE P22303 2/20 0.48
MEN1 O00255 2/20 0.48
NPC1 O15118 2/20 0.48
POLB P06746 2/20 0.48
USP2 O75604 1/20 0.48
CACNA1B Q00975 1/20 0.48
APBA1 Q02410 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
GLA P06280 1/20 0.47

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
SCHEMBL29402115 1.00 MAPT (0.71) MAPTALDH1A1GAAHPGDKDM4E
SCHEMBL2246928 1.00 MAPT (0.71) MAPTALDH1A1GAAHPGDKDM4E
SCHEMBL7912388 0.87 MAPT (0.56) MAPTALDH1A1GAAHPGDKDM4E
SCHEMBL10659938 0.86 MAPT (0.62) MAPTALDH1A1GAAHPGDKDM4E
SCHEMBL15196666 0.85 MAPT (0.53) MAPTALDH1A1GAAHPGDKDM4E
SCHEMBL15196665 0.85 MAPT (0.53) MAPTALDH1A1GAAHPGDKDM4E
Phenazine SCHEMBL9049 0.84 MAPT (1.00) MAPTALDH1A1GAAHPGDKDM4E
Phenazine SCHEMBL27643128 0.84 MAPT (1.00) MAPTALDH1A1GAAHPGDKDM4E
Phenazine SCHEMBL29356959 0.84 MAPT (1.00) MAPTALDH1A1GAAHPGDKDM4E
SCHEMBL4654883 0.83 MAPT (0.69) MAPTALDH1A1GAAHPGDKDM4E

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
CN-114300723-A Water-based organic flow battery based on mixed energy storage of insoluble phenazine-based negative electrode and soluble phenazine-based negative electrode electrolyte 常州大学 2022-04-08 CN disclosed