SCHEMBL9968210

SCHEMBL9968210

Cc1cc(-n2c3ccccc3c3cnc(CC(C)C)cc32)ccc1-c1ccc(-n2c3ccccc3c3cnc(CC(C)C)cc32)cc1C

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.35
TLR7 Q9NYK1 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
DRD1 P21728 4/20 0.32
DRD5 P21918 4/20 0.32
PTPN1 P18031 1/20 0.31
POLB P06746 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
SCHEMBL9968194 0.89 KDM4E (0.42) PARP1TLR7KDM4EATML3MBTL1
SCHEMBL9968241 0.81 KDM4E (0.36) PARP1TLR7KDM4EATML3MBTL1
SCHEMBL29462706 0.78 KDM4E (0.52) KDM4EATML3MBTL1PTPN1POLB
SCHEMBL29349946 0.78 KDM4E (0.52) KDM4EATML3MBTL1PTPN1POLB
SCHEMBL63587 0.78 KDM4E (0.52) KDM4EATML3MBTL1PTPN1POLB
SCHEMBL13049632 0.75 KDM4E (0.48) KDM4EATML3MBTL1PTPN1POLB
SCHEMBL10100831 0.75 KDM4E (0.48) KDM4EATML3MBTL1PTPN1POLB
SCHEMBL20717612 0.75 MAOA (0.46) KDM4EATML3MBTL1POLB
SCHEMBL4570444 0.75 MAOA (0.46) KDM4EATML3MBTL1POLB
SCHEMBL10100904 0.75 MAOA (0.46) KDM4EATML3MBTL1POLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed
US-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed