SCHEMBL2274706

SCHEMBL2274706

FC(F)(F)SOc1cccc(Br)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.43
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA5A P35218 1/20 0.37
CA9 Q16790 1/20 0.37
CYP1A2 P05177 3/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
ATM Q13315 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KMT2A Q03164 2/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
SOD1 P00441 1/20 0.36

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
SCHEMBL29351368 0.75 MAOB (0.46) MAOBHTTSLC6A4ALDH1A1GAA
SCHEMBL278324 0.75 MAOB (0.46) MAOBHTTSLC6A4ALDH1A1GAA
SCHEMBL7903124 0.73 LTA4H (0.41) RAB9AL3MBTL1CA5AATMALDH1A1
SCHEMBL14157395 0.72 MAOB (0.43) MAOBCA1CA2CA5ACA9
SCHEMBL27219499 0.72 MAOB (0.43) MAOBHTTRAB9AL3MBTL1CA1
SCHEMBL4875079 0.72 MAOB (0.43) MAOBHTTRAB9AL3MBTL1CA1
SCHEMBL11720083 0.72 MAOB (0.43) MAOBHTTRAB9AL3MBTL1CA1
SCHEMBL457828 0.71 MAOB (0.54) MAOBKMT2ASLC6A2SLC6A4SLC6A3
SCHEMBL1471132 0.71 MAOB (0.55) MAOBHTTRAB9AL3MBTL1SOD1
SCHEMBL29705679 0.71 MAOB (0.55) MAOBHTTRAB9AL3MBTL1SOD1

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-8492007-B2 Metal complex and organic electroluminescent device SUMITOMO CHEMICAL COMPANY (JP) 2013-07-23 US disclosed
US-20110227050-A1 METAL COMPLEX AND ORGANIC ELETROLUMINESCENT DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-09-22 US disclosed
US-8003226-B2 carbazole phenylpyridine metal complexes or conjugated with additional polymers, for use in a light-emitting device; light emission from triplet excited state SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-23 US disclosed
US-20050147843-A1 carbazole phenylpyridine metal complexes or conjugated with additional polymers, for use in a light-emitting device; light emission from triplet excited state SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-07-07 US disclosed