SCHEMBL20208601

SCHEMBL20208601

c1ccc(-c2cccc(-c3ccc4c(c3)Oc3cc(-c5cccc(-c6ccccc6)c5)cc5c3N4c3cc4c6ccccc6n(-c6ccccc6)c4cc3O5)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
HDAC4 P56524 1/20 0.31
KMT2A Q03164 2/20 0.30
IL1R1 P14778 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL20208602 0.98 L3MBTL1 (0.41) L3MBTL1KDM4EATMHDAC4KMT2A
SCHEMBL20208610 0.88 KDM4E (0.38) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL22958706 0.88 L3MBTL1 (0.40) L3MBTL1KDM4EATMHDAC4KMT2A
SCHEMBL22958727 0.87 L3MBTL1 (0.42) L3MBTL1KDM4EATMHDAC4KMT2A
SCHEMBL20209199 0.87 ATM (0.38) L3MBTL1KDM4EATMALDH1A1HTT
SCHEMBL20208726 0.87 KDM4E (0.41) L3MBTL1KDM4EATMALDH1A1
SCHEMBL22958792 0.86 L3MBTL1 (0.45) L3MBTL1KDM4EATMHDAC4KMT2A
SCHEMBL25636733 0.86 L3MBTL1 (0.40) L3MBTL1KDM4EATMHDAC4KMT2A
SCHEMBL19035998 0.86 ATM (0.35) L3MBTL1KDM4EATMHDAC4ALDH1A1
SCHEMBL19036003 0.85 EDNRB (0.35) L3MBTL1KDM4EATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3544986-B1 BRIDGED TRIARYLAMINES FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-12-23 EP disclosed
WO-2018095839-A1 BRIDGED TRIARYLAMINES FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-05-31 WO disclosed