SCHEMBL20080392

SCHEMBL20080392

c1ccc(-c2c3ccccc3c(-c3ccccc3)c3nsnc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
MAPT P10636 3/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ESR1 P03372 5/20 0.38
ESR2 Q92731 5/20 0.38
ALDH1A1 P00352 2/20 0.38
ACHE P22303 2/20 0.38
ALPL P05186 1/20 0.38
GAA P10253 1/20 0.38
IDO1 P14902 1/20 0.38
HPGD P15428 1/20 0.38
TTK P33981 1/20 0.38
MAPK10 P53779 1/20 0.38
LMNA P02545 2/20 0.37
HTT P42858 1/20 0.37
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA2B P29275 1/20 0.36

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
SCHEMBL21241626 0.96 KDM4E (0.39) KDM4EMAPTMAPK1TDP1L3MBTL1
SCHEMBL18083022 0.86 ALDH1A1 (0.37) KDM4EMAPTMAPK1TDP1L3MBTL1
SCHEMBL22931692 0.83 ALDH1A1 (0.38) KDM4EMAPTMAPK1TDP1L3MBTL1
SCHEMBL14701343 0.82 ESR1 (0.36) KDM4EMAPTMAPK1TDP1L3MBTL1
SCHEMBL13276007 0.80 MAPT (0.41) KDM4EMAPTMAPK1TDP1L3MBTL1
SCHEMBL13228950 0.80 AKT2 (0.39) KDM4EMAPTL3MBTL1ALDH1A1LMNA
SCHEMBL19104413 0.78 PDPK1 (0.36) KDM4EMAPTMAPK1ALDH1A1LMNA
SCHEMBL24418065 0.78 MAPT (0.50) KDM4EMAPTMAPK1TDP1L3MBTL1
SCHEMBL14515098 0.77 ESR1 (0.33) KDM4EMAPTMAPK1TDP1L3MBTL1
SCHEMBL2807430 0.77 CYP19A1 (0.46) KDM4EMAPTTDP1ESR1ESR2

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-3312897-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND MANUFACTURING METHOD THEREOF Kunshan Go-Visionox Opto-Electronics Co., Ltd. (CN) 2018-04-25 EP disclosed