SCHEMBL10694615

SCHEMBL10694615

N#Cc1cccc2nc(O)c(O)nc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.42
PKMYT1 Q99640 2/20 0.39
NR1H2 P55055 1/20 0.39
ALDH1A1 P00352 4/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 2/20 0.37
SOS2 Q07890 1/20 0.37
HTT P42858 1/20 0.37
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ESR2 Q92731 1/20 0.35
PSMB8 P28062 1/20 0.35
TSHR P16473 1/20 0.33
NQO2 P16083 1/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL9670627 0.81 HTT (0.39) ACHEALDH1A1GAAMAPTKMT2A
SCHEMBL9669419 0.81 SOS2 (0.39) ACHEALDH1A1GAAKDM4ESOS2
SCHEMBL1998596 0.80 ALDH1A1 (0.50) ACHEPKMYT1NR1H2ALDH1A1GAA
SCHEMBL25193602 0.77 TDP1 (0.46) PKMYT1NR1H2ALDH1A1GAANPSR1
SCHEMBL25187861 0.77 PARP1 (0.39) ACHEPKMYT1NR1H2ALDH1A1GAA
SCHEMBL28345776 0.76 NR1H2 (0.41) ACHEPKMYT1NR1H2ALDH1A1GAA
SCHEMBL7595836 0.74 L3MBTL1 (0.41) PKMYT1NR1H2ALDH1A1GAAMAPT
SCHEMBL29029513 0.73 KDM4E (0.49) PKMYT1NR1H2ALDH1A1GAAMAPT
SCHEMBL28345818 0.73 ALDH1A1 (0.63) PKMYT1NR1H2ALDH1A1MAPTRAB9A
SCHEMBL28063770 0.73 ACHE (0.77) ACHEALDH1A1GAAMAPTRAB9A

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
EP-0260467-A2 Quinoxaline compounds and their preparation and use NOVO NORDISK A/S (DK) 1988-03-23 EP disclosed