SCHEMBL19720306

SCHEMBL19720306

CC1CC=Cc2c1n(-c1ccc(-c3c4ccccc4c(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccc(Br)cc34)cc1)c1ccccc21

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ L3MBTL1 Q9Y468 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
SCHEMBL18568854 0.85 KDM4E (0.40) HDAC4KDM4EATML3MBTL1
SCHEMBL21388324 0.84 KDM4E (0.36) HDAC4KDM4EATML3MBTL1
SCHEMBL20707565 0.80 KDM4E (0.40) HDAC4KDM4EATML3MBTL1
SCHEMBL13903725 0.80 KDM4E (0.37) HDAC4KDM4EATML3MBTL1
SCHEMBL10458489 0.80 L3MBTL1 (0.47) HDAC4KDM4EATML3MBTL1
SCHEMBL23341282 0.80 KMT2A (0.34) KDM4EATML3MBTL1
SCHEMBL14468834 0.78 — —
SCHEMBL20460059 0.78 DRD1 (0.33) HDAC4KDM4EATML3MBTL1
SCHEMBL22415195 0.78 KDM4E (0.40) KDM4EATML3MBTL1
SCHEMBL25956652 0.78 KDM4E (0.40) KDM4EATML3MBTL1

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-1991514-B1 NOVEL ANTHRACENE DERIVATIVE AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG CHEMICAL LTD (KR) 2017-12-20 — — EP disclosed
Send feedback