SCHEMBL17033893

SCHEMBL17033893

c1ccc(-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-n3c4ccccc4c4ccc5c(cc6c7ccccc7c7ccccc7n65)c43)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL17033443 0.92 L3MBTL1 (0.39) KDM4EATML3MBTL1
SCHEMBL17033438 0.91 L3MBTL1 (0.37) KDM4EATML3MBTL1TSHRHSD17B10
SCHEMBL17033459 0.90 KDM4E (0.35) KDM4EATML3MBTL1TSHR
SCHEMBL17033448 0.90 KDM4E (0.35) KDM4EATML3MBTL1TSHR
SCHEMBL17033454 0.89 KDM4E (0.36) KDM4EATML3MBTL1TSHRHSD17B10
SCHEMBL17033449 0.89 KDM4E (0.38) KDM4EATML3MBTL1TSHRHSD17B10
SCHEMBL17033441 0.89 KDM4E (0.34) KDM4EATML3MBTL1
SCHEMBL17033775 0.87 MEN1 (0.33) KDM4EATML3MBTL1TSHRHSD17B10
SCHEMBL17033743 0.87 PTGER4 (0.33) KDM4EATML3MBTL1
SCHEMBL17033444 0.87 KDM4E (0.33) KDM4EATML3MBTL1TSHRHSD17B10

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-2015125986-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 WO disclosed