SCHEMBL19918629

SCHEMBL19918629

c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4c6cccc7c6c(cc4n5-c4ccc5sc6ccccc6c5c4)-c4ccccc4-7)ccc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TSPO P30536 1/20 0.31
ALOX5 P09917 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
SCHEMBL19918647 1.00 KDM4E (0.36) KDM4EATML3MBTL1TSPOALOX5
SCHEMBL19918497 1.00 KDM4E (0.36) KDM4EATML3MBTL1TSPOALOX5
SCHEMBL19918562 0.96 TSPO (0.34) KDM4EATML3MBTL1TSPO
SCHEMBL19918496 0.95 KDM4E (0.35) KDM4EATML3MBTL1
SCHEMBL19918501 0.95 L3MBTL1 (0.34) KDM4EATML3MBTL1ALOX5
SCHEMBL19918642 0.94 KDM4E (0.36) KDM4EATML3MBTL1TSPOALOX5
SCHEMBL19918640 0.94 KDM4E (0.36) KDM4EATML3MBTL1TSPOALOX5
SCHEMBL19918549 0.94 L3MBTL1 (0.35) KDM4EATML3MBTL1ALOX5
SCHEMBL19918495 0.94 ALOX5 (0.33) L3MBTL1ALOX5
SCHEMBL19918552 0.92 PIM3 (0.34) KDM4EATML3MBTL1TSPOALOX5

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
WO-2018038400-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING SAME 주식회사 두산 2018-03-01 WO disclosed