SCHEMBL1126087

SCHEMBL1126087

CCN1CCN(Cc2c[nH]c([N+](=O)[O-])n2)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.43
CYP2D6 P10635 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 2/20 0.39
HPGD P15428 1/20 0.39
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 5/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
LMNA P02545 2/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL1126117 0.90 KDM4E (0.39) ALDH1A1CYP2D6KMT2AKDM4ESMN1; SMN2
SCHEMBL1126079 0.86 ALDH1A1 (0.41) ALDH1A1L3MBTL1KMT2AKDM4EMEN1
SCHEMBL1126099 0.82 SMN1; SMN2 (0.48) ALDH1A1L3MBTL1KMT2AHPGDMEN1
SCHEMBL3316970 0.75 ALDH1A1 (0.39) ALDH1A1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL1126491 0.75 KMT2A (0.39) ALDH1A1KMT2AKDM4ESMN1; SMN2
SCHEMBL3316965 0.72 PARP1 (0.35) ALDH1A1KMT2AKDM4EMEN1MAPT
SCHEMBL1126343 0.72 RAB9A (0.33) ALDH1A1
SCHEMBL1126086 0.72 CYP1A2 (0.34) ALDH1A1CYP2D6KMT2AHPGDKDM4E
SCHEMBL11109785 0.71 MAPT (0.31) ALDH1A1KMT2AHPGDKDM4EMEN1
SCHEMBL17770528 0.71 L3MBTL1 (0.40) ALDH1A1L3MBTL1KMT2AKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240132796-A1 TRIBOLOGICAL SYSTEM KLUEBER LUBRICATION MUENCHEN SE & CO. KG (DE) 2024-04-25 US claimed
US-11905483-B2 Tribological system KLUEBER LUBRICATION MUENCHEN SE & CO. KG (DE) 2024-02-20 US claimed
WO-2024017517-A1 LUBRICANT COMPOSITION CONTAINING AN IONIC LIQUID KLUEBER LUBRICATION MUENCHEN SE & CO. KG (DE) 2024-01-25 WO claimed
EP-4239039-A1 LUBRICATING COMPOSITION COMPRISING AN IONIC LIQUID Klüber Lubrication München SE & Co. KG (DE) 2023-09-06 EP claimed
US-20230063820-A1 TRIBOLOGICAL SYSTEM KLUEBER LUBRICATION MUENCHEN SE & CO. KG (DE) 2023-03-02 US claimed
EP-4100558-A1 TRIBOLOGICAL SYSTEM Klüber Lubrication München SE & Co. KG (DE) 2022-12-14 EP claimed
EP-4073213-A1 USE OF A LUBRICATING GREASE COMPOSITION HAVING A HIGH UPPER USE TEMPERATURE Klüber Lubrication München SE & Co. KG (DE) 2022-10-19 EP claimed
WO-2021115685-A1 USE OF A LUBRICATING GREASE COMPOSITION HAVING A HIGH UPPER USE TEMPERATURE KLUEBER LUBRICATION MUENCHEN SE & CO. KG (DE) 2021-06-17 WO claimed
US-20100105586-A1 LUBRICATING GREASE COMPOSITION KLUBER LUBRICATION MUNCHEN KG (DE) 2010-04-29 US claimed
EP-1420012-B1 Process for the preparation of aliphatic isocyanates from aromatic isocyanates DEGUSSA (DE) 2006-11-02 EP claimed
EP-4384589-A1 USE OF HEMIMELLITIC ESTER AS A BASE OIL FOR LUBRICANT COMPOSITIONS Klüber Lubrication München SE & Co. KG (DE) 2024-06-19 EP disclosed
US-20240132796-A1 TRIBOLOGICAL SYSTEM KLUEBER LUBRICATION MUENCHEN SE & CO. KG (DE) 2024-04-25 US disclosed
US-11905483-B2 Tribological system KLUEBER LUBRICATION MUENCHEN SE & CO. KG (DE) 2024-02-20 US disclosed
EP-3913039-B1 BLEND OF ESTER COMPOUNDS KLUEBER LUBRICATION MUENCHEN SE & CO KG (DE) 2024-01-31 EP disclosed
WO-2024017517-A1 LUBRICANT COMPOSITION CONTAINING AN IONIC LIQUID KLUEBER LUBRICATION MUENCHEN SE & CO. KG (DE) 2024-01-25 WO disclosed
US-8258088-B2 Lubricating grease composition KLüBER LUBRICATION MüNCHEN KG (DE) 2012-09-04 US disclosed
EP-2282995-A1 DERIVATIVES OF QUINOLINES AND QUINOXALINES AS PROTEIN TYROSINE KINASE INHIBITORS Novartis AG (CH) 2011-02-16 EP disclosed
US-20100105667-A1 Quinoxaline- and Quinoline-Carboxamide Derivatives NOVARTIS AG 2010-04-29 US disclosed
US-20100105586-A1 LUBRICATING GREASE COMPOSITION KLUBER LUBRICATION MUNCHEN KG (DE) 2010-04-29 US disclosed
WO-2009141386-A1 DERIVATIVES OF QUINOLINES AND QUINOXALINES AS PROTEIN TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2009-11-26 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 (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-20100105667-A1 Quinoxaline- and Quinoline-Carboxamide Derivatives ABL1, NQO2, MAP4K5 ALDH1A1 2916/4885CYP2D6 192/4885L3MBTL1 4384/4885

“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.