SCHEMBL10048166

SCHEMBL10048166

O=C1C(c2ccccc2)=C2C(=C1c1ccccc1)c1cc3cccc4ccc5ccc2c1c5c43

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.39
ESR2 Q92731 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 4/20 0.36
CES1 P23141 2/20 0.36
CES2 O00748 1/20 0.36
BCHE P06276 1/20 0.36
MCL1 Q07820 1/20 0.36
CASP1 P29466 2/20 0.36
CASP7 P55210 2/20 0.36
CYP3A4 P08684 2/20 0.36
PABPC1 P11940 1/20 0.36
DNMT1 P26358 1/20 0.36
HPGD P15428 2/20 0.35
TSHR P16473 2/20 0.35
HSD17B10 Q99714 2/20 0.35
TP53 P04637 1/20 0.35
MAPK1 P28482 1/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL29773784 0.81 ALDH1A1 (0.56) MEN1KMT2AALDH1A1CES1CES2
SCHEMBL75606 0.81 ALDH1A1 (0.56) MEN1KMT2AALDH1A1CES1CES2
SCHEMBL14732732 0.80 ALDH1A1 (0.35) MEN1KMT2AALDH1A1CES1CES2
SCHEMBL12683614 0.79 ESR1 (0.40) ESR1ESR2ALDH1A1CES1CES2
SCHEMBL14732729 0.78 CDC25A (0.41) MEN1KMT2AALDH1A1CES1CES2
SCHEMBL10304455 0.78 ALDH1A1 (0.54) ESR1ESR2MEN1KMT2AALDH1A1
SCHEMBL9995145 0.77 ESR1 (0.44) ESR1ESR2MEN1KMT2AALDH1A1
SCHEMBL21889361 0.76 ALDH1A1 (0.44) ESR1ESR2MEN1KMT2AALDH1A1
SCHEMBL10047211 0.76 ALDH1A1 (0.58) MEN1KMT2AALDH1A1CES1CES2
SCHEMBL10015037 0.74 ALDH1A1 (0.41) MEN1KMT2AALDH1A1CES1CASP1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9166173-B2 Organic compound CANON KABUSHIKI KAISHA (JP) 2015-10-20 US disclosed
US-9166173-B2 Organic compound CANON KABUSHIKI KAISHA (JP) 2015-10-20 US disclosed
US-9099656-B2 Organic compound and organic light-emitting device including same CANON KABUSHIKI KAISHA (JP) 2015-08-04 US disclosed
US-9099656-B2 Organic compound and organic light-emitting device including same CANON KABUSHIKI KAISHA (JP) 2015-08-04 US disclosed
US-8968890-B2 Organic compound and organic light-emitting device having the same CANON KABUSHIKI KAISHA (JP) 2015-03-03 US disclosed
US-8968889-B2 Organic compound and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2015-03-03 US disclosed
US-8968890-B2 Organic compound and organic light-emitting device having the same CANON KABUSHIKI KAISHA (JP) 2015-03-03 US disclosed
US-8968889-B2 Organic compound and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2015-03-03 US disclosed
US-8829502-B2 Condensed polycyclic compound and organic light emitting element including the same CANON KABUSHIKI KAISHA (JP) 2014-09-09 US disclosed
US-8829502-B2 Condensed polycyclic compound and organic light emitting element including the same CANON KABUSHIKI KAISHA (JP) 2014-09-09 US disclosed
US-20130048965-A1 CONDENSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-02-28 US disclosed
US-20130048965-A1 CONDENSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-02-28 US disclosed
US-20130001543-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-01-03 US disclosed
US-20130001543-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-01-03 US disclosed
US-20130002526-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2013-01-03 US disclosed
US-20130002526-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2013-01-03 US disclosed
WO-2012017977-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING SAME CANON KABUSHIKI KAISHA (JP) 2012-02-09 WO disclosed
WO-2011158767-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-12-22 WO disclosed
WO-2011145637-A1 NOVEL ORGANIC COMPOUND CANON KABUSHIKI KAISHA (JP) 2011-11-24 WO disclosed
WO-2011121935-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2011-10-06 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 (2 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-20130048965-A1 CONDENSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT INCLUDING THE SAME CCNE2, NFE2L2, CRY2 ESR1 169/4885ESR2 181/4885MEN1 634/4885
US-20130002526-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE MRPL38, RPS8, RPS19 ESR1 241/4885ESR2 835/4885MEN1 1508/4885

“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.