SCHEMBL449879

SCHEMBL449879

O=C(O)c1ccnc(-c2cc(C(=O)O)cc(-c3cc(C(=O)O)ccn3)n2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5C P41229 9/20 0.68
KDM4C Q9H3R0 8/20 0.68
KDM4A O75164 7/20 0.68
KDM4E B2RXH2 6/20 0.68
KDM2A Q9Y2K7 5/20 0.68
KDM3A Q9Y4C1 5/20 0.68
KDM6B O15054 4/20 0.68
P4HA1 P13674 1/20 0.66
KDM5B Q9UGL1 8/20 0.63
KDM4B O94953 4/20 0.63
JMJD6 Q6NYC1 1/20 0.60
KDM5A P29375 4/20 0.57
TET3 O43151 1/20 0.57
BBOX1 O75936 1/20 0.57
ALDH1A1 P00352 1/20 0.57
MAPT P10636 1/20 0.57
ASPH Q12797 1/20 0.57
KDM4D Q6B0I6 1/20 0.57
TET2 Q6N021 1/20 0.57
ALKBH5 Q6P6C2 1/20 0.57

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
SCHEMBL7637853 1.00 KDM5C (0.68) KDM5CKDM4CKDM4AKDM4EKDM2A
SCHEMBL29699785 1.00 KDM5C (0.68) KDM5CKDM4CKDM4AKDM4EKDM2A
SCHEMBL30892481 0.98 KDM5C (0.66) KDM5CKDM4CKDM4AKDM4EKDM2A
SCHEMBL29407015 0.92 KDM4C (0.78) KDM5CKDM4CKDM4AKDM4EKDM2A
SCHEMBL70700 0.92 KDM4C (0.78) KDM5CKDM4CKDM4AKDM4EKDM2A
SCHEMBL16976900 0.91 KDM5C (0.73) KDM5CKDM4CKDM4AKDM4EKDM2A
SCHEMBL18677557 0.90 KDM5C (0.57) KDM5CKDM4CKDM4AKDM4EKDM2A
SCHEMBL863220 0.90 KDM5C (0.87) KDM5CKDM4CKDM4AKDM4EKDM2A
SCHEMBL8572040 0.90 KDM5B (0.60) KDM5CKDM4CKDM4AKDM4EKDM2A
SCHEMBL25273097 0.90 KDM4C (0.75) KDM5CKDM4CKDM4AKDM4EKDM2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111100445-B Polyamide composition and preparation method and application thereof 中国石油化工股份有限公司 2022-07-12 CN claimed
CN-113281500-A Magnetic bead for single molecule detection and preparation method thereof 深圳市光与生物科技有限公司 2021-08-20 CN claimed
CN-111100445-A Polyamide composition and preparation method and application thereof 中国石油化工股份有限公司 2020-05-05 CN claimed
CN-109456315-A Carbon-aryl glycoside class SGLT-2 inhibitor precursor and its synthetic method 上海大学 2019-03-12 CN claimed
US-20150361267-A1 Process for the Synthesis of Precursor Complexes of Titanium Dioxide Sensitization Dyes Based on Ruthenium Polypyridine Complexes DYEPOWER (IT) 2015-12-17 US claimed
US-20140046064-A1 Process for the Synthesis of Precursor Complexes of Titanium Dioxide Sensitization Dyes Based on Ruthenium Polypyridine Complexes DYEPOWER (IT) 2014-02-13 US claimed
US-8507679-B2 Heteroleptic, dual tridentate Ru(II) complexes as sensitizers for dye-sensitized solar cells NATIONAL TSING HUA UNIVERSITY (TW) 2013-08-13 US claimed
US-20120073660-A1 HETEROLEPTIC, DUAL TRIDENTATE RU(II) COMPLEXES AS SENSITIZERS FOR DYE-SENSITIZED SOLAR CELLS NATIONAL TSING HUA UNIVERSITY (TW) 2012-03-29 US claimed
US-6936143-B1 Tandem cell for water cleavage by visible light ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2005-08-30 US claimed
EP-1198621-B1 TANDEM CELL FOR WATER CLEAVAGE BY VISIBLE LIGHT ECOLE POLYTECH (CH) 2003-10-01 EP claimed
EP-1178084-A1 Processes for the preparation of carboxylate and phosphonate ruthenium polypyridine dyes and intermediates Neomat S.A. (LU) 2002-02-06 EP claimed
WO-2024010829-A1 PHOTO-CATALYTIC ANTIMICROBIAL PACKAGING FILMS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2024-01-11 WO disclosed
CN-113281500-B Magnetic bead for single molecule detection and preparation method thereof 深圳市光与生物科技有限公司 2022-07-12 CN disclosed
CN-111100445-B Polyamide composition and preparation method and application thereof 中国石油化工股份有限公司 2022-07-12 CN disclosed
CN-113281500-A Magnetic bead for single molecule detection and preparation method thereof 深圳市光与生物科技有限公司 2021-08-20 CN disclosed
US-6500510-B1 TRANSITION METAL COMPLEXES IN PHOTOCHROMIC DEVICES; STABLE, LONG TERM DATA STORAGE MOLECULAR STORAGE TECHNOLOGIES, INC. 2002-12-31 US disclosed
EP-1178084-A1 Processes for the preparation of carboxylate and phosphonate ruthenium polypyridine dyes and intermediates Neomat S.A. (LU) 2002-02-06 EP disclosed
US-6245988-B1 USEFUL IN A PHOTOVOLTAIC CELL COMPRISING A NANOCRYSTALLINE TITANIUM DIOXIDE LAYER; IMPROVING THE EFFICIENCY OF SOLAR TO ELECTRIC POWER CONVERSION BY PROVIDING PHOTOSENSITIZER HAVING ENHANCED SPECTRAL RESPONSE IN RED/INFRARED REGIONS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2001-06-12 US disclosed
EP-0758337-B1 PHOSPHONATED POLYPYRIDYL COMPOUNDS AND THEIR COMPLEXES ECOLE POLYTECH (CH) 1998-12-16 EP disclosed
US-5789592-A Phosphonated polypyridyl compounds and their complexes ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 1998-08-04 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 (1 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-20120073660-A1 HETEROLEPTIC, DUAL TRIDENTATE RU(II) COMPLEXES AS SENSITIZERS FOR DYE-SENSITIZED SOLAR CELLS RUVBL2, RUVBL1, CCNL2 KDM5C 3148/4885KDM4C 3048/4885KDM4A 3412/4885

“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.