SCHEMBL20006904

SCHEMBL20006904

c1ccc(-c2ccc3c4ccccc4n(-c4ccc(-c5ccc(-n6c7cc(-c8ccccc8)ccc7c7c(-c8ccc9c(c8)c8ccccc8n9-c8cccc(-n9c%10ccccc%10c%10ccccc%109)c8)cccc76)cc5)cc4)c3c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ATM Q13315 1/20 0.43
HDAC4 P56524 1/20 0.37
TSPO P30536 1/20 0.35
ALK Q9UM73 1/20 0.34
DNM1 Q05193 1/20 0.33
KMT2A Q03164 2/20 0.33
IL1R1 P14778 1/20 0.33
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
PTGER4 P35408 1/20 0.32
PDE10A Q9Y233 1/20 0.32
JAK2 O60674 1/20 0.32
JAK3 P52333 1/20 0.32
EDNRB P24530 1/20 0.31

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
SCHEMBL21310207 0.98 L3MBTL1 (0.45) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL20655021 0.96 L3MBTL1 (0.42) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL22590235 0.95 L3MBTL1 (0.41) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL25671993 0.95 L3MBTL1 (0.43) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL20654998 0.95 L3MBTL1 (0.43) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL20633772 0.95 KDM4E (0.45) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL25671995 0.94 L3MBTL1 (0.42) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL21894741 0.94 L3MBTL1 (0.44) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL24525984 0.94 L3MBTL1 (0.46) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL24525997 0.94 L3MBTL1 (0.46) L3MBTL1KDM4EATMHDAC4ALK

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3728263-B1 HETEROCYCLIC COMPOUNDS FOR USE IN ELECTRONIC DEVICES. MERCK PATENT GMBH (DE) 2022-06-15 EP disclosed
EP-3601304-B1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2021-10-27 EP disclosed
EP-3507294-B1 BINUCLEAR AND TRINUCLEAR METAL COMPLEXES COMPOSED OF TWO INTER-LINKED TRIPODAL HEXADENTATE LIGANDS FOR USE IN ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-02-24 EP disclosed
EP-3117470-B1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2020-12-23 EP disclosed
EP-3526228-B1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2020-11-25 EP disclosed
EP-3515925-B1 BINUCLEAR METAL COMPLEXES FOR USE AS EMITTERS IN ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-10-21 EP disclosed
EP-3526226-B1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2020-07-22 EP disclosed
EP-3526227-B1 BINUCLEAR METAL COMPLEXES AND ELECTRONIC DEVICES, IN PARTICULAR ORGANIC ELECTROLUMINESCENT DEVICES CONTAINING SAID METAL COMPLEXES MERCK PATENT GMBH (DE) 2020-06-03 EP disclosed
WO-2019179909-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2019-09-26 WO disclosed
WO-2019158453-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2019-08-22 WO disclosed
WO-2019115423-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2019-06-20 WO disclosed
WO-2019020538-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2019-01-31 WO disclosed
WO-2018069197-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2018-04-19 WO disclosed
WO-2018054798-A1 BINUCLEAR METAL COMPLEXES FOR USE AS EMITTERS IN ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-03-29 WO disclosed