SCHEMBL1410106

SCHEMBL1410106

Cn1ccnc1-c1c2nc(c(-c3nccn3C)c3ccc([nH]3)c(-c3nccn3C)c3nc(c(-c4nccn4C)c4ccc1[nH]4)C=C3)C=C2

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 4/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ CASP1 P29466 1/20 0.43
▸ CASP7 P55210 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ TOP1 P11387 2/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.38
▸ CYCS P99999 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
SCHEMBL12836952 0.88 KDM4E (0.36) TERTKDM4ECASP1CASP7HSD17B10
SCHEMBL1409926 0.88 TOP1 (0.44) TERTTOP1ABCG2CYCS
SCHEMBL17018807 0.87 KDM4E (0.38) TERTKDM4ECASP1CASP7HSD17B10
SCHEMBL10314954 0.85 TOP1 (0.43) TERTKDM4ECASP1CASP7HSD17B10
SCHEMBL12763748 0.84 KDM4E (0.36) TERTKDM4ECASP1CASP7HSD17B10
SCHEMBL1410123 0.83 STAT3 (0.50) TERTKDM4ECASP1CASP7HSD17B10
SCHEMBL7717047 0.83 TERT (0.37) TERTKDM4ECASP1CASP7HSD17B10
SCHEMBL17356731 0.83 KDM4E (0.33) TERTKDM4ECASP1CASP7HSD17B10
SCHEMBL1410167 0.81 ABCG2 (0.57) TERTKDM4ETOP1ABCG2CYCS
SCHEMBL10314951 0.80 KDM4E (0.31) TERTKDM4ECASP1CASP7HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9459545-B2 Electrophotographic photosensitive member, manufacturing method of electrophotographic photosensitive member, process cartridge and electrophotographic apparatus, and a solid solution and manufacturing method of a solid solution CANON KABUSHIKI KAISHA (JP) 2016-10-04 — — US disclosed
US-9289434-B2 Substituted porphyrins AEOLUS SCIENCES, INC. (US) 2016-03-22 — — US disclosed
US-9289434-B2 Substituted porphyrins AEOLUS SCIENCES, INC. (US) 2016-03-22 — — US disclosed
US-9289434-B2 Substituted porphyrins AEOLUS SCIENCES, INC. (US) 2016-03-22 — — US disclosed
US-20150370181-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, MANUFACTURING METHOD OF ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE AND ELECTROPHOTOGRAPHIC APPARATUS, AND A SOLID SOLUTION AND MANUFACTURING METHOD OF A SOLID SOLUTION CANON KABUSHIKI KAISHA (JP) 2015-12-24 — — US disclosed
US-20150231150-A1 SUBSTITUTED PORPHYRINS AEOLUS PHARMACEUTICALS INC. 2015-08-20 — — US disclosed
US-20150231150-A1 SUBSTITUTED PORPHYRINS AEOLUS PHARMACEUTICALS INC. 2015-08-20 — — US disclosed
US-20150231150-A1 SUBSTITUTED PORPHYRINS AEOLUS PHARMACEUTICALS INC. 2015-08-20 — — US disclosed
US-8946202-B2 Substituted porphyrins AEOLUS SCIENCES, INC. (US) 2015-02-03 — — US disclosed
US-8946202-B2 Substituted porphyrins AEOLUS SCIENCES, INC. (US) 2015-02-03 — — US disclosed
US-20070197496-A1 for modulating cellular levels of oxidants such as superoxide radicals, hydrogen peroxide, peroxynitrite, lipid peroxides, hydroxyl radicals and thiyl radicals, treating diabetes mellitus Type I or Type II NATIONAL JEWISH MEDICAL AND RESEARCH CENTER 2007-08-23 — — US disclosed
US-7245851-B2 Electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2007-07-17 — — US disclosed
US-7189707-B2 Substituted porphyrins NATIONAL JEWISH MEDICAL RESEARCH CENTER (US) 2007-03-13 — — US disclosed
US-7189707-B2 Substituted porphyrins NATIONAL JEWISH MEDICAL RESEARCH CENTER (US) 2007-03-13 — — US disclosed
US-7189707-B2 Substituted porphyrins NATIONAL JEWISH MEDICAL RESEARCH CENTER (US) 2007-03-13 — — US disclosed
EP-1616869-A1 Substituted porphyrins and their therapeutic use National Jewish Medical and Research Center (US) 2006-01-18 — — EP disclosed
EP-1155019-B1 SUBSTITUTED PORPHYRINS AND THEIR THERAPEUTIC USE NAT JEWISH MED & RES CENTER (US) 2005-12-07 — — EP disclosed
US-20050008687-A1 Metal-porphyrin-complex-embedded liposomes, production process thereof, and medicines making use of the same MAKOTO YUASA (JP) 2005-01-13 — — US disclosed
US-20040023941-A1 Modulating physiological and pathological processes and, in particular, to a method of modulating cellular levels of oxidants and thereby processes in which such oxidants are a participant. The invention also relates to compounds and NATIONAL JEWISH MEDICAL AND RESEARCH CENTER 2004-02-05 — — US disclosed
US-6544975-B1 Mimetics that inhibit lipid peroxidation; for use in the treatment of diseases or disorders mediated by oxidative stress, such as asthma, inflammatory bowel disease, arthritis and vasculitis. NATIONAL JEWISH MEDICAL AND RESEARCH CENTER 2003-04-08 — — 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 (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-20150231150-A1 SUBSTITUTED PORPHYRINS PPOX, GPX4, PRDX5 TERT 821/4885KDM4E 3901/4885CASP1 823/4885
US-20040023941-A1 Modulating physiological and pathological processes and, in particular, to a method of modulating cellular levels of oxidants and thereby processes in which such oxidants are a participant. The invention also relates to compounds and TXN2, PRDX5, GPX4 TERT 2424/4885KDM4E 4317/4885CASP1 1440/4885
US-20050008687-A1 Metal-porphyrin-complex-embedded liposomes, production process thereof, and medicines making use of the same GPX4, FECH, PPOX TERT 2685/4885KDM4E 2437/4885CASP1 3066/4885
US-20070197496-A1 for modulating cellular levels of oxidants such as superoxide radicals, hydrogen peroxide, peroxynitrite, lipid peroxides, hydroxyl radicals and thiyl radicals, treating diabetes mellitus Type I or Type II GPX4, LPO, TXNRD2 TERT 771/4885KDM4E 4038/4885CASP1 1140/4885

“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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