SCHEMBL2604812

SCHEMBL2604812

c1ccc(-c2cccc(-c3ccc(N(c4ccc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4)c4cccc5ccccc45)cc3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ATM Q13315 1/20 0.42
HDAC4 P56524 1/20 0.37
TSPO P30536 1/20 0.34
KMT2A Q03164 3/20 0.32
SIGMAR1 Q99720 3/20 0.32
IL1R1 P14778 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
HTT P42858 2/20 0.32
PER2 O15055 1/20 0.31
HPGD P15428 1/20 0.31
CRY1 Q16526 1/20 0.31
CRY2 Q49AN0 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CA12 O43570 1/20 0.31

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
SCHEMBL2604799 1.00 L3MBTL1 (0.42) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL10029911 0.99 L3MBTL1 (0.41) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL15752444 0.96 KDM4E (0.40) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL16356585 0.96 TSPO (0.40) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL13620184 0.96 L3MBTL1 (0.46) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL12704841 0.96 L3MBTL1 (0.46) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL10029866 0.96 L3MBTL1 (0.46) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL19533767 0.95 L3MBTL1 (0.41) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL15138441 0.95 KDM4E (0.41) L3MBTL1KDM4EATMHDAC4TSPO
SCHEMBL14755943 0.95 KDM4E (0.41) L3MBTL1KDM4EATMHDAC4TSPO

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-20120091438-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-04-19 US disclosed
US-20120091438-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-04-19 US disclosed