SCHEMBL14228010

SCHEMBL14228010

c1ccc2c(-c3c4ccccc4c(-c4ccc(-c5nc6ccccc6nc5-c5ccc(-c6c7ccccc7c(-c7cccc8ccccc78)c7ccccc67)cc5)cc4)c4ccccc34)cccc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.44
LMNA P02545 4/20 0.43
KDM4E B2RXH2 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
CYP1A2 P05177 1/20 0.41
ALDH1A1 P00352 3/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
AHR P35869 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40
MAPK10 P53779 1/20 0.40
MAPK14 Q16539 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
DHFR P00374 1/20 0.40

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
SCHEMBL25801266 0.86 ENPP3 (0.49) L3MBTL1LMNAKDM4EMEN1KMT2A
SCHEMBL17300193 0.85 MEN1 (0.39) L3MBTL1LMNAKDM4EMEN1KMT2A
SCHEMBL17034889 0.84 MEN1 (0.38) L3MBTL1LMNAKDM4EMEN1KMT2A
SCHEMBL16814673 0.84 CA12 (0.49) L3MBTL1KDM4EGAATDP1CYP1A2
SCHEMBL29751906 0.84 CA12 (0.49) L3MBTL1KDM4EGAATDP1CYP1A2
SCHEMBL14525852 0.83 BCHE (0.43) L3MBTL1LMNAKDM4EKMT2AGAA
SCHEMBL14228009 0.83 ESR1 (0.44) L3MBTL1LMNAKDM4EMEN1KMT2A
SCHEMBL13614904 0.83 LMNA (0.51) L3MBTL1LMNAKDM4EMEN1KMT2A
SCHEMBL1766036 0.82 L3MBTL1 (0.62) L3MBTL1LMNAKDM4EMEN1KMT2A
SCHEMBL22470183 0.82 L3MBTL1 (0.62) L3MBTL1LMNAKDM4EMEN1KMT2A

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-2008047589-A1 QUINOXALINE DERIVATIVE, AND LIGHT-EMITTING ELEMENT AND LIGHT-EMITTING DEVICE USING QUINOXALINE DERIVATIVE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2008-04-24 WO disclosed