SCHEMBL13709261

SCHEMBL13709261

C1=Cc2c(n(-c3ccc4c(c3)c3cc(-n5c6c(c7ccccc75)C=CCC6)ccc3n4-c3ccccc3)c3ccccc23)CC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SIGMAR1 Q99720 1/20 0.34
KDR P35968 1/20 0.32
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
PTPN1 P18031 1/20 0.31
MAPK8 P45983 1/20 0.30
KMT2A Q03164 1/20 0.30
IL1R1 P14778 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
SCHEMBL12846413 0.99 KDM4E (0.46) KDM4EATML3MBTL1SIGMAR1KDR
SCHEMBL19452419 0.94 KDM4E (0.39) KDM4EATML3MBTL1
SCHEMBL19114596 0.93 KDM4E (0.40) KDM4EATML3MBTL1SIGMAR1EDNRB
SCHEMBL20049001 0.93 KDM4E (0.43) KDM4EATML3MBTL1SIGMAR1KDR
SCHEMBL24280780 0.91 KDM4E (0.46) KDM4EATML3MBTL1SIGMAR1KDR
SCHEMBL13062420 0.90 L3MBTL1 (0.48) KDM4EATML3MBTL1SIGMAR1KDR
SCHEMBL17636194 0.90 KDM4E (0.36) KDM4EATML3MBTL1
SCHEMBL23837867 0.90 KDM4E (0.43) KDM4EATML3MBTL1SIGMAR1KDR
SCHEMBL25865748 0.90 KDM4E (0.36) KDM4EATML3MBTL1KMT2A
SCHEMBL26752787 0.90 ATM (0.37) 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-2096690-A2 Organic electroluminescence device FUJIFILM Corporation (JP) 2009-09-02 EP disclosed