SCHEMBL21385121

SCHEMBL21385121

Brc1ccc(-c2ccc(-c3ccc(-c4ccc5c(c4)Oc4ccnc6cccc-5c46)cc3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
CDK1 P06493 2/20 0.33
KDR P35968 2/20 0.33
CDK2 P24941 2/20 0.33
PLK4 O00444 1/20 0.33
AURKA O14965 1/20 0.33
JAK2 O60674 1/20 0.33
LCK P06239 1/20 0.33
CSF1R P07333 1/20 0.33
LYN P07948 1/20 0.33
FGFR1 P11362 1/20 0.33
SRC P12931 1/20 0.33
PRKACA P17612 1/20 0.33
RPS6KB1 P23443 1/20 0.33
MARK3 P27448 1/20 0.33
AKT1 P31749 1/20 0.33
AKT2 P31751 1/20 0.33
BLK P51451 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
SCHEMBL21385331 0.90 BIRC5 (0.41) MAPK1KDM4EATMCYP1A2ALDH1A1
SCHEMBL21382855 0.89 AHR (0.42) MAPK1KDM4EATMCYP1A2CYP2C19
SCHEMBL17283782 0.79 MAPK1 (0.57) MAPK1KDM4EATMCDK1KDR
SCHEMBL23587905 0.77 KDM4E (0.31) MAPK1KDM4EATMALDH1A1NPC1
SCHEMBL21382887 0.77 LIPG (0.39) KDREGFR
SCHEMBL23587864 0.77 KDM4E (0.31) MAPK1KDM4EATM
SCHEMBL21383190 0.75 MAOA (0.37) MAPK1KDM4EATMCDK2PIK3CA
SCHEMBL21382869 0.70 LIPG (0.38) MAPK1KDM4EATMKDREGFR
SCHEMBL13507781 0.70 KDM4E (0.41) MAPK1KDM4EATMHTTALDH1A1
SCHEMBL17283705 0.70 MAPK1 (0.56) MAPK1KDM4EATMALDH1A1HPGD

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-2019182360-A1 COMPOUND, ORGANIC LIGHT-EMITTING DEVICE AND DISPLAY DEVICE 에스케이머티리얼즈 주식회사 2019-09-26 WO disclosed