SCHEMBL21074308

SCHEMBL21074308

C1=Cc2c(c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc3n2-c2ccc3c(c2)c2cc(-c4ccc5c6ccc(-c7cccc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)c7)cc6c6ccccc6c5c4)ccc2n3-c2ccccc2)CC1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TSPO P30536 1/20 0.30
HDAC4 P56524 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
SCHEMBL17920279 0.95 KDM4E (0.39) KDM4EATML3MBTL1HDAC4
SCHEMBL19003923 0.95 KDM4E (0.39) KDM4EATML3MBTL1HDAC4
SCHEMBL21923270 0.94 ATM (0.38) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL26156841 0.94 L3MBTL1 (0.40) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL17012686 0.93 ATM (0.39) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL21923269 0.93 ATM (0.36) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL21583501 0.92 ATM (0.35) KDM4EATML3MBTL1TSPO
SCHEMBL29343543 0.92 L3MBTL1 (0.42) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL26252230 0.92 KDM4E (0.42) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL27390259 0.91 ATM (0.38) KDM4EATML3MBTL1HDAC4

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-3492480-A2 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2019-06-05 EP disclosed