SCHEMBL12731978

SCHEMBL12731978

c1ccc(-c2cc(-c3cnc4c(ccc5ccncc54)c3)c(-c3ccccc3)c3c2-c2cccc4cccc-3c24)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 3/20 0.50
MAPK10 P53779 1/20 0.42
KDM4E B2RXH2 3/20 0.37
HASPIN Q8TF76 1/20 0.36
ALOX5 P09917 1/20 0.35
MAPT P10636 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
PIK3CD O00329 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
PARP1 P09874 1/20 0.34
ACVR1 Q04771 1/20 0.33
MET P08581 1/20 0.33
TDO2 P48775 2/20 0.33
CLK1 P49759 1/20 0.33
DYRK1A Q13627 1/20 0.33
CDC7 O00311 1/20 0.32
CDK2 P24941 1/20 0.32
CYP2A6 P11509 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
SCHEMBL2734550 0.89 KDM4E (0.46) TNFKDM4EALDH1A1HPGDPARP1
SCHEMBL12731968 0.85 CCR1 (0.43) TNFKDM4EMAPTPARP1MET
SCHEMBL12731984 0.84 LMNA (0.43) MAPK10KDM4EMAPTALDH1A1HPGD
SCHEMBL12731981 0.83 KDM4E (0.46) KDM4EMAPTPARP1CYP2A6
SCHEMBL12731988 0.79 CCR1 (0.39) TNFKDM4EMAPTALDH1A1PARP1
SCHEMBL2734566 0.78 TNF (0.45) TNFKDM4EMAPTALDH1A1HPGD
SCHEMBL2734767 0.78 BIRC5 (0.47) PIK3CDPIK3CBPIK3CGMETCYP2A6
SCHEMBL12731980 0.77 L3MBTL1 (0.40) TNFMAPTALDH1A1METDYRK1A
SCHEMBL251545 0.77 CYP11B1 (0.48) TNFKDM4EMAPTALDH1A1HPGD
SCHEMBL12731985 0.76 IDO1 (0.39) TNFKDM4EMAPTTDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7931975-B2 Electroluminescent device containing a flouranthene compound GLOBAL OLED TECHNOLOGY LLC (US) 2011-04-26 US disclosed
US-7931975-B2 Electroluminescent device containing a flouranthene compound GLOBAL OLED TECHNOLOGY LLC (US) 2011-04-26 US disclosed
US-20100117519-A1 ELECTROLUMINESCENT DEVICE CONTAINING A FLOURANTHENE COMPOUND GLOBAL OLED TECHNOLOGY LLC 2010-05-13 US disclosed
US-20100117519-A1 ELECTROLUMINESCENT DEVICE CONTAINING A FLOURANTHENE COMPOUND GLOBAL OLED TECHNOLOGY LLC 2010-05-13 US disclosed