Sugi Predict

Sugi Predict / Compounds / SCHEMBL10047211

SCHEMBL10047211

SCHEMBL10047211

O=C1C(=O)c2cc3cccc4ccc5ccc1c2c5c43

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.58
▸ CES1 P23141 2/20 0.58
▸ CES2 O00748 1/20 0.58
▸ BCHE P06276 1/20 0.58
▸ MCL1 Q07820 1/20 0.58
▸ CYP3A4 P08684 2/20 0.46
▸ CYP1A1 P04798 2/20 0.46
▸ CYP1B1 Q16678 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ TSHR P16473 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ DNMT1 P26358 3/20 0.45
▸ CASP1 P29466 2/20 0.45
▸ CASP7 P55210 2/20 0.45
▸ PABPC1 P11940 2/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MAPK1 P28482 2/20 0.40
▸ TP53 P04637 1/20 0.40

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
SCHEMBL15119568 0.80 TYMS (0.61) ALDH1A1CES1CES2BCHEMCL1
SCHEMBL10047410 0.78 CASP1 (0.55) ALDH1A1CES1CES2BCHEMCL1
SCHEMBL12071291 0.78 ALDH1A1 (0.39) ALDH1A1CES1CES2BCHEMCL1
SCHEMBL14719119 0.77 ALDH1A1 (0.64) ALDH1A1CYP3A4CYP1A1CYP1B1HPGD
SCHEMBL29532031 0.77 ALDH1A1 (0.58) ALDH1A1CES1CES2BCHEMCL1
SCHEMBL29367436 0.77 ALDH1A1 (0.58) ALDH1A1CES1CES2BCHEMCL1
SCHEMBL652259 0.77 ALDH1A1 (0.58) ALDH1A1CES1CES2BCHEMCL1
SCHEMBL10048166 0.76 ESR1 (0.39) ALDH1A1CES1CES2BCHEMCL1
SCHEMBL14732729 0.76 CDC25A (0.41) ALDH1A1CES1CES2BCHEMCL1
SCHEMBL29762006 0.75 ALDH1A1 (0.71) ALDH1A1CES1CES2BCHEMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190048129-A1 A POLYMER, COMPOSITION, FORMING SACRIFICIAL LAYER AND METHOD FOR SEMICONDUCTOR DEVICE THEREWITH AZ ELECTRONIC MATERIALS (LUXEMBOURG) S.A.R.L. (LU) 2019-02-14 — — US disclosed
WO-2017137142-A1 A POLYMER, COMPOSITION, FORMING SACRIFICIAL LAYER AND METHOD FOR SEMICONDUCTOR DEVICE THEREWITH AZ Electronic Materials (Luxembourg) S.à.r.l. (LU) 2017-08-17 — — WO disclosed
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-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-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-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-20130002526-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE 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-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
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 ALDH1A1 1007/4885CES1 3750/4885CES2 3465/4885
US-20130002526-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE MRPL38, RPS8, RPS19 ALDH1A1 265/4885CES1 2721/4885CES2 2687/4885

“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.