SCHEMBL16613341

SCHEMBL16613341

CC1(C)C=c2nc(-n3c4ccccc4c4ccccc43)nc(-c3ccccc3-c3ccccc3)c2=C1

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL16613498 0.90 KDM4E (0.35) KDM4EATML3MBTL1
SCHEMBL16613408 0.90
SCHEMBL16613340 0.88 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL16613431 0.87 TUBB4A (0.34)
SCHEMBL16613418 0.87 TUBB4A (0.36) KDM4E
SCHEMBL16613448 0.86 KDM4E (0.38) KDM4EATML3MBTL1
SCHEMBL16613425 0.86 KDM4E (0.30) KDM4EATML3MBTL1
SCHEMBL16613442 0.86 L3MBTL1 (0.33) KDM4EATML3MBTL1
SCHEMBL16613337 0.85 ENPP3 (0.35)
SCHEMBL16613499 0.85

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-2015047058-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed