SCHEMBL10058040

SCHEMBL10058040

OC1(c2ccccc2)c2ccccc2Cc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ P2RX1 P51575 1/20 0.44
▸ P2RX3 P56373 1/20 0.44
▸ P2RX4 Q99571 1/20 0.44
▸ P2RX7 Q99572 1/20 0.44
▸ HTR2A P28223 3/20 0.44
▸ DRD2 P14416 1/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ CCR1 P32246 1/20 0.40
▸ HDAC9 Q9UKV0 2/20 0.38
▸ CHRM2 P08172 1/20 0.37
▸ CHRM4 P08173 1/20 0.37
▸ CHRM5 P08912 1/20 0.37
▸ CHRM1 P11229 1/20 0.37
▸ CHRM3 P20309 1/20 0.37
▸ AKR1C1 Q04828 1/20 0.36
▸ SRD5A2 P31213 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL7320496 0.87 CHRM2 (0.47) P2RX1P2RX3P2RX4P2RX7HTR2A
SCHEMBL19263420 0.81 SRD5A2 (0.40) P2RX1P2RX3P2RX4P2RX7HTR2A
SCHEMBL1758787 0.81 P2RX1 (0.53) P2RX1P2RX3P2RX4P2RX7SLC6A2
SCHEMBL29525488 0.77 HTR2A (0.47) HTR2ADRD2SLC6A2HTR2CSLC6A4
SCHEMBL11870176 0.77 HTR2A (0.47) HTR2ADRD2SLC6A2HTR2CSLC6A4
SCHEMBL21842177 0.77 HTR2A (0.50) HTR2ADRD2SLC6A2HTR2CSLC6A4
SCHEMBL7263231 0.77 HTR2A (0.50) HTR2ADRD2SLC6A2HTR2CSLC6A4
SCHEMBL25883143 0.76 SLC6A2 (0.43) HTR2ADRD2SLC6A2HTR2CSLC6A4
SCHEMBL10472443 0.76 CHRM2 (0.43) P2RX1P2RX3P2RX4P2RX7HTR2A
SCHEMBL813078 0.75 THRB (0.52) P2RX1P2RX3P2RX4P2RX7SLC6A2

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 6 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
US-20130037790-A1 NOVEL 10,10-DIALKYLANTHRONE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-02-14 — — US disclosed
US-20130037790-A1 NOVEL 10,10-DIALKYLANTHRONE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-02-14 — — 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
WO-2011136059-A1 NOVEL 10,10-DIALKYLANTHRONE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-11-03 — — WO disclosed
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