SCHEMBL23222575

SCHEMBL23222575

c1ccc(-c2cccc3c2-c2ccccc2C32c3ccccc3-c3c(-c4ccc(-n5c6ccccc6c6cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc65)cc4)cccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ATM Q13315 1/20 0.43
KMT2A Q03164 2/20 0.35
TSPO P30536 1/20 0.33
HDAC4 P56524 1/20 0.33
IL1R1 P14778 1/20 0.33
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
EDNRA P25101 2/20 0.31
EDNRB P24530 1/20 0.31
MAPK14 Q16539 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
SCHEMBL23222653 0.98 KDM4E (0.40) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL20411907 0.96 KDM4E (0.39) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL16810669 0.94 KDM4E (0.42) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL19001823 0.93 L3MBTL1 (0.39) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL18160235 0.93 L3MBTL1 (0.41) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL15593172 0.93 L3MBTL1 (0.45) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL22183379 0.92 KDM4E (0.35) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL18160226 0.92 KDM4E (0.38) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL16810663 0.92 KDM4E (0.38) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL18160234 0.92 KDM4E (0.37) L3MBTL1KDM4EATMKMT2ATSPO

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-3390365-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-04-14 EP disclosed