SCHEMBL10057544

SCHEMBL10057544

O=C1c2cc(Br)ccc2C2(c3ccc(Br)cc31)c1ccccc1-c1ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ PTPRC P08575 2/20 0.53
▸ CYP1A2 P05177 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ S100A4 P26447 2/20 0.45
▸ PDK2 Q15119 1/20 0.44
▸ BCL2 P10415 2/20 0.43
▸ MCL1 Q07820 1/20 0.43
▸ EDNRB P24530 1/20 0.42
▸ EDNRA P25101 1/20 0.42
▸ TGM2 P21980 1/20 0.42
▸ CES1 P23141 1/20 0.42
▸ PARP1 P09874 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ CDC25B P30305 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ OPRM1 P35372 1/20 0.39
▸ OPRD1 P41143 1/20 0.39
▸ CA1 P00915 1/20 0.39

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
SCHEMBL10057547 0.93 PTPRC (0.51) TDP1L3MBTL1PTPRCCYP1A2MAPK1
SCHEMBL29603046 0.88 PDK2 (0.49) TDP1L3MBTL1PTPRCCYP1A2MAPK1
SCHEMBL45620 0.88 PDK2 (0.49) TDP1L3MBTL1PTPRCCYP1A2MAPK1
SCHEMBL16628918 0.88 PDK2 (0.49) TDP1L3MBTL1PTPRCCYP1A2MAPK1
SCHEMBL12469930 0.88 PDK2 (0.49) TDP1L3MBTL1PTPRCCYP1A2MAPK1
SCHEMBL31396648 0.88 PDK2 (0.49) TDP1L3MBTL1PTPRCCYP1A2MAPK1
SCHEMBL29603475 0.88 PDK2 (0.49) TDP1L3MBTL1PTPRCCYP1A2MAPK1
SCHEMBL31396643 0.88 PDK2 (0.49) TDP1L3MBTL1PTPRCCYP1A2MAPK1
SCHEMBL29603405 0.88 PDK2 (0.49) TDP1L3MBTL1PTPRCCYP1A2MAPK1
SCHEMBL10057463 0.87 PTPRC (0.52) TDP1L3MBTL1PTPRCCYP1A2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130105786-A1 NOVEL SPIRO(ANTHRACENE-9,9'-FLUOREN)-10-ONE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-05-02 — — US disclosed
US-20130105786-A1 NOVEL SPIRO(ANTHRACENE-9,9'-FLUOREN)-10-ONE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-05-02 — — US disclosed
WO-2012008557-A1 NOVEL SPIRO (ANTHRACENE-9,9'-FLUOREN) -10-ONE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2012-01-19 — — WO disclosed
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