SCHEMBL16282996

SCHEMBL16282996

c1ccc(-n2c3ccccc3c3ccc(-c4ccc(-n5c6ccccc6c6c7oc8ccccc8c7ccc65)cc4)cc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ATM Q13315 1/20 0.43
ALDH1A1 P00352 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HSD17B10 Q99714 2/20 0.39
POLB P06746 2/20 0.39
TSHR P16473 1/20 0.39
BRCA1 P38398 1/20 0.39
PPARG P37231 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
NR2E3 Q9Y5X4 1/20 0.35
NCOR2 Q9Y618 1/20 0.35
HDAC4 P56524 1/20 0.35
ALOX5 P09917 1/20 0.34
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
PLA2G2A P14555 1/20 0.32
PLA2G4A P47712 1/20 0.32

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
SCHEMBL24676116 0.98 KDM4E (0.40) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL24675403 0.98 KDM4E (0.40) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL24675492 0.98 KDM4E (0.40) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL16283012 0.97 L3MBTL1 (0.40) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL16283044 0.97 L3MBTL1 (0.40) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL15137655 0.96 L3MBTL1 (0.39) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL15337945 0.95 KDM4E (0.43) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL16283021 0.95 KDM4E (0.43) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL15137591 0.95 KDM4E (0.43) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL15337954 0.94 KDM4E (0.44) KDM4EL3MBTL1ATMALDH1A1MEN1

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-20140364625-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM & HAAS ELECT MAT (KR) 2014-12-11 US disclosed
US-20140364625-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM & HAAS ELECT MAT (KR) 2014-12-11 US disclosed