SCHEMBL10015037

SCHEMBL10015037

O=C1C(c2ccccc2)=C2C(=C1c1ccccc1)c1cc3c4ccccc4ccc3c3cccc2c13

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
HPGD P15428 5/20 0.41
HSD17B10 Q99714 4/20 0.41
TSHR P16473 3/20 0.41
MAPK1 P28482 3/20 0.41
CASP1 P29466 2/20 0.41
HIF1A Q16665 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HPRT1 P00492 4/20 0.40
CYP1A1 P04798 3/20 0.40
CYP1B1 Q16678 2/20 0.40
CYP1A2 P05177 6/20 0.39
CYP2C9 P11712 3/20 0.39
CYP2C19 P33261 3/20 0.39
FYN P06241 2/20 0.38
AHR P35869 2/20 0.38
ERBB2 P04626 1/20 0.38
MAOA P21397 1/20 0.38
ACHE P22303 1/20 0.38
SOS1 Q07889 2/20 0.38

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
SCHEMBL10304455 0.88 ALDH1A1 (0.54) ALDH1A1HPGDHSD17B10TSHRMAPK1
SCHEMBL14680387 0.81 PTPN1 (0.41) ALDH1A1HPGDHSD17B10TSHRMAPK1
SCHEMBL10015036 0.81 CES1 (0.51) ALDH1A1HPGDHSD17B10TSHRMAPK1
SCHEMBL17070126 0.78 MAPK1 (0.56) ALDH1A1HPGDHSD17B10TSHRMAPK1
SCHEMBL12683614 0.78 ESR1 (0.40) ALDH1A1HPGDHSD17B10MAPK1CASP1
SCHEMBL21889361 0.77 ALDH1A1 (0.44) ALDH1A1HPGDHSD17B10TSHRMAPK1
SCHEMBL75606 0.77 ALDH1A1 (0.56) ALDH1A1HPGDHSD17B10TSHRMAPK1
SCHEMBL29773784 0.77 ALDH1A1 (0.56) ALDH1A1HPGDHSD17B10TSHRMAPK1
SCHEMBL2302722 0.75 ALDH1A1 (0.71) ALDH1A1HPGDHSD17B10TSHRMAPK1
SCHEMBL17487173 0.75 ALDH1A1 (0.45) ALDH1A1HPGDHSD17B10TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8586207-B2 Fused polycyclic compound and organic light emitting device having the compound CANON KABUSHIKI KAISHA (JP) 2013-11-19 US disclosed
US-20120013700-A1 NOVEL FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2012-01-19 US disclosed
US-20120013700-A1 NOVEL FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2012-01-19 US disclosed
US-20110315973-A1 NOVEL FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2011-12-29 US disclosed
US-20110315973-A1 NOVEL FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2011-12-29 US disclosed
US-20110240982-A1 BENZOINDENOCHRYSENE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-10-06 US disclosed
US-20110240982-A1 BENZOINDENOCHRYSENE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-10-06 US disclosed
US-20110147731-A1 CONDENSED RING AROMATIC COMPOUND FOR ORGANIC LIGHT-EMITTING DEVICE AND ORGANIC LIGHT-EMITTING DEVICE HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-06-23 US disclosed
US-20110147731-A1 CONDENSED RING AROMATIC COMPOUND FOR ORGANIC LIGHT-EMITTING DEVICE AND ORGANIC LIGHT-EMITTING DEVICE HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-06-23 US disclosed
US-7919198-B2 Condensed ring aromatic compound for organic light-emitting device and organic light-emitting device having the same CANON KABUSHIKI KAISHA (JP) 2011-04-05 US disclosed
US-7919198-B2 Condensed ring aromatic compound for organic light-emitting device and organic light-emitting device having the same CANON KABUSHIKI KAISHA (JP) 2011-04-05 US disclosed
US-20110024737-A1 FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE HAVING THE COMPOUND CANON KABUSHIKI KAISHA (JP) 2011-02-03 US disclosed
US-20110024737-A1 FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE HAVING THE COMPOUND CANON KABUSHIKI KAISHA (JP) 2011-02-03 US disclosed
US-20100327274-A1 ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2010-12-30 US disclosed
US-20100327274-A1 ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2010-12-30 US disclosed
US-20100026171-A1 CONDENSED RING AROMATIC COMPOUND FOR ORGANIC LIGHT-EMITTING DEVICE AND ORGANIC LIGHT-EMITTING DEVICE HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2010-02-04 US disclosed
US-20100026171-A1 CONDENSED RING AROMATIC COMPOUND FOR ORGANIC LIGHT-EMITTING DEVICE AND ORGANIC LIGHT-EMITTING DEVICE HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2010-02-04 US disclosed
WO-2009123344-A1 ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2009-10-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110315973-A1 NOVEL FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE NR2E3, PYM1, TYR ALDH1A1 1824/4885HPGD 2624/4885HSD17B10 2971/4885
US-20110024737-A1 FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE HAVING THE COMPOUND MAP1LC3C, MAP1LC3A, MAP1LC3B ALDH1A1 2801/4885HPGD 3994/4885HSD17B10 2901/4885
US-20110240982-A1 BENZOINDENOCHRYSENE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CDKL1, XDH, TYR ALDH1A1 350/4885HPGD 2966/4885HSD17B10 2625/4885
US-20100026171-A1 CONDENSED RING AROMATIC COMPOUND FOR ORGANIC LIGHT-EMITTING DEVICE AND ORGANIC LIGHT-EMITTING DEVICE HAVING THE SAME TYR, AHR, CRY1 ALDH1A1 172/4885HPGD 3051/4885HSD17B10 2220/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.