SCHEMBL11874455

SCHEMBL11874455

C=CCC1=C(C)C(=O)C(OC)=C(OC)C1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.51
▸ LMNA P02545 3/20 0.51
▸ MAPT P10636 3/20 0.50
▸ TDP1 Q9NUW8 3/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ THRB P10828 1/20 0.50
▸ CYP3A4 P08684 3/20 0.49
▸ CYP2D6 P10635 2/20 0.49
▸ CYP2C9 P11712 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ PGR P06401 1/20 0.49
▸ MAOA P21397 1/20 0.49
▸ TBXA2R P21731 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ AVPR2 P30518 1/20 0.49
▸ HTR2B P41595 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ PDE3A Q14432 1/20 0.49
▸ SIRT2 Q8IXJ6 1/20 0.49
▸ SLC29A1 Q99808 1/20 0.49

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
SCHEMBL6047529 0.88 IDO1 (0.40) IDO1LMNAMAPTTDP1ALDH1A1
SCHEMBL4318927 0.79 LMNA (0.61) IDO1LMNAMAPTTDP1ALDH1A1
Coenzyme Q1 SCHEMBL1129498 0.78 LMNA (0.73) IDO1LMNAMAPTTDP1ALDH1A1
SCHEMBL3171268 0.77 MAOB (0.33) ALOX15
SCHEMBL14894680 0.76 MAPT (0.67) IDO1LMNAMAPTTDP1ALDH1A1
SCHEMBL13033957 0.75 MAPT (0.61) IDO1LMNAMAPTTDP1ALDH1A1
SCHEMBL14895856 0.74 IDO1 (0.62) IDO1LMNAMAPTTDP1ALDH1A1
SCHEMBL2625087 0.74 LMNA (0.68) IDO1LMNAMAPTTDP1ALDH1A1
SCHEMBL24783643 0.74 IDO1 (0.56) IDO1LMNAMAPTTDP1ALDH1A1
SCHEMBL7393149 0.74 MAPT (0.62) IDO1LMNAMAPTTDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2911656-B1 QUINONE BASED NITRIC OXIDE DONATING COMPOUNDS FOR OPHTHALMIC USE NICOX SA (FR) 2020-12-02 — — EP disclosed
US-9446015-B2 Quinone based nitric oxide donating compounds for ophthalmic use NICOX SCIENCE IRELAND (IE) 2016-09-20 — — US disclosed
WO-2015155234-A1 QUINONE BASED NITRIC OXIDE DONATING COMPOUNDS NICOX SCIENCE IRELAND (IE) 2015-10-15 — — WO disclosed
US-20150283106-A1 QUINONE BASED NITRIC OXIDE DONATING COMPOUNDS FOR OPHTHALMIC USE NICOX SA (FR) 2015-10-08 — — US disclosed
EP-2911656-A1 QUINONE BASED NITRIC OXIDE DONATING COMPOUNDS FOR OPHTHALMIC USE Nicox Science Ireland (IE) 2015-09-02 — — EP disclosed
US-9079821-B2 Quinone based nitric oxide donating compounds NICOX SCIENCE IRELAND (IE) 2015-07-14 — — US disclosed
US-9061962-B2 Quinone based nitric oxide donating compounds NICOX SCIENCE IRELAND (IE) 2015-06-23 — — US disclosed
EP-2707354-B1 QUINONE BASED NITRIC OXIDE DONATING COMPOUNDS NICOX SCIENCE IRELAND (IE) 2015-04-29 — — EP disclosed
US-20140342998-A1 QUINONE BASED NITRIC OXIDE DONATING COMPOUNDS NICOX S.A. (FR) 2014-11-20 — — US disclosed
US-20140135389-A1 QUINONE BASED NITRIC OXIDE DONATING COMPOUNDS NICOX SA (FR) 2014-05-15 — — US disclosed
EP-2722326-A1 Quinone based nitric oxide donating compounds NICOX S.A. (FR) 2014-04-23 — — EP disclosed
EP-2707354-A1 QUINONE BASED NITRIC OXIDE DONATING COMPOUNDS Nicox S.A. (FR) 2014-03-19 — — EP disclosed
WO-2013060673-A1 QUINONE BASED NITRIC OXIDE DONATING COMPOUNDS NICOX S.A. (FR) 2013-05-02 — — WO disclosed
US-8388950-B2 Coenzyme Q10-containing water-soluble composition and process for production thereof KANEKA CORPORATION (JP) 2013-03-05 — — US disclosed
US-20070293572-A1 Anti-Fatigue Composition KANEKA CORPORATION (JP) 2007-12-20 — — US disclosed
US-20070259908-A1 Mitochondria Activators KANEKA CORPORATION (JP) 2007-11-08 — — US disclosed
US-20070243180-A1 Composition Containing Reduced Coenzyme Q KANEKA CORPORATION (JP) 2007-10-18 — — US disclosed
US-20070196349-A1 Whitening composition containing reduced coenzyme Q KANEKA CORPORATION (JP) 2007-08-23 — — US disclosed
US-20070122400-A1 Composition having liver function protecting effect KANEKA CORPORATION (JP) 2007-05-31 — — US disclosed
US-3974187-A BENZOQUINONES, 6-ALKYL- WAN YIEH PING 1976-08-10 — — US 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 (8 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-20070243180-A1 Composition Containing Reduced Coenzyme Q NDUFA6, COQ8A, NDUFA9 IDO1 3575/4885LMNA 2436/4885MAPT 863/4885
US-20070259908-A1 Mitochondria Activators CS, TFAM, COQ8A IDO1 3048/4885LMNA 3777/4885MAPT 1297/4885
US-20070122400-A1 Composition having liver function protecting effect SQOR, GPX1, CPT1A IDO1 563/4885LMNA 2222/4885MAPT 4219/4885
US-20150283106-A1 QUINONE BASED NITRIC OXIDE DONATING COMPOUNDS FOR OPHTHALMIC USE NOS1, NOS3, NOS2 IDO1 419/4885LMNA 2979/4885MAPT 2671/4885
US-20070196349-A1 Whitening composition containing reduced coenzyme Q NDUFA7, NDUFA11, NDUFA12 IDO1 470/4885LMNA 406/4885MAPT 1567/4885
US-20140135389-A1 QUINONE BASED NITRIC OXIDE DONATING COMPOUNDS NOS2, NQO1, NOS1 IDO1 336/4885LMNA 2252/4885MAPT 2605/4885
US-20070293572-A1 Anti-Fatigue Composition CPT1B, CPT1A, SLC25A20 IDO1 1100/4885LMNA 2426/4885MAPT 3437/4885
US-20140342998-A1 QUINONE BASED NITRIC OXIDE DONATING COMPOUNDS NOS2, NQO1, NOS1 IDO1 336/4885LMNA 2252/4885MAPT 2605/4885

“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.

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