SCHEMBL14901014

SCHEMBL14901014

O=C1c2cc(Br)ccc2C(O)(c2ccccc2-c2ccccc2)c2ccc(Br)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PTPRC P08575 1/20 0.45
CYP1A2 P05177 1/20 0.43
MAPK1 P28482 1/20 0.43
EDNRB P24530 2/20 0.43
EDNRA P25101 2/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.41
PARP1 P09874 1/20 0.41
PDK2 Q15119 1/20 0.41
BCL2 P10415 1/20 0.40
MCL1 Q07820 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
AKR1C3 P42330 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
SCHEMBL10057683 0.94 PTPRC (0.44) TDP1L3MBTL1PTPRCCYP1A2MAPK1
SCHEMBL19164107 0.88 PDK2 (0.46) TDP1PTPRCMAPK1PTGDR2PARP1
SCHEMBL490501 0.86 PDK2 (0.47) TDP1PTPRCMAPK1PTGDR2PARP1
SCHEMBL761313 0.86 PDK2 (0.47) TDP1PTPRCMAPK1PTGDR2PARP1
SCHEMBL24730387 0.85 PDK2 (0.51) TDP1PTPRCMAPK1PTGDR2PARP1
SCHEMBL824160 0.83 PDK2 (0.55) TDP1PTPRCMAPK1PTGDR2PDK2
SCHEMBL30463510 0.83 PDK2 (0.55) TDP1PTPRCMAPK1PTGDR2PDK2
SCHEMBL1978583 0.83 PDK2 (0.55) TDP1PTPRCMAPK1PTGDR2PDK2
SCHEMBL19164437 0.81 PDK2 (0.54) TDP1PTPRCMAPK1PTGDR2PDK2
SCHEMBL19164438 0.81 PDK2 (0.54) TDP1PTPRCMAPK1PTGDR2PDK2

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-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