SCHEMBL2537598

SCHEMBL2537598

O=C(CC(=O)c1cc(Cl)ccn1)CC(=O)c1cc(Cl)ccn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPT P10636 1/20 0.54
KDM4C Q9H3R0 1/20 0.50
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
GRM5 P41594 2/20 0.42
GRM4 Q14833 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
KMT2A Q03164 2/20 0.40
TSHR P16473 1/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.39
KDR P35968 1/20 0.38
PYGL P06737 1/20 0.38
PYGM P11217 1/20 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
SCHEMBL4215189 0.91 GRM4 (0.52) L3MBTL1ALDH1A1MAPTNPC1RAB9A
SCHEMBL4311423 0.83 MAPT (0.47) L3MBTL1ALDH1A1MAPTKDM4CNPC1
SCHEMBL27028359 0.83 ALDH1A1 (0.53) L3MBTL1ALDH1A1MAPTKDM4CNPC1
SCHEMBL15907862 0.82 PLOD2 (0.49) L3MBTL1ALDH1A1MAPTKDM4CNPC1
SCHEMBL12019619 0.81 ALDH1A1 (0.54) L3MBTL1ALDH1A1MAPTKDM4CNPC1
SCHEMBL21437805 0.81 L3MBTL1 (0.54) L3MBTL1ALDH1A1MAPTKDM4CNPC1
SCHEMBL27911792 0.81 ALDH1A1 (0.63) L3MBTL1ALDH1A1MAPTKDM4CNPC1
SCHEMBL6888866 0.81 L3MBTL1 (0.54) L3MBTL1ALDH1A1MAPTKDM4CNPC1
SCHEMBL17875258 0.81 L3MBTL1 (0.54) L3MBTL1ALDH1A1MAPTKDM4CNPC1
SCHEMBL6889314 0.81 ALDH1A1 (0.54) L3MBTL1ALDH1A1MAPTKDM4CNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8044013-B2 Complex of manganese, titanium, nickel, copper, cobalt, iron and ligands BASF SE (DE) 2011-10-25 US disclosed
US-8044013-B2 Complex of manganese, titanium, nickel, copper, cobalt, iron and ligands BASF SE (DE) 2011-10-25 US disclosed
US-8044013-B2 Complex of manganese, titanium, nickel, copper, cobalt, iron and ligands BASF SE (DE) 2011-10-25 US disclosed
US-7692004-B2 Use of metal complex compounds as oxidation catalysts CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-04-06 US disclosed
US-7692004-B2 Use of metal complex compounds as oxidation catalysts CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-04-06 US disclosed
US-7692004-B2 Use of metal complex compounds as oxidation catalysts CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-04-06 US disclosed
US-20090189119-A1 Use of metal complex compounds comprising pyridine pyrimidine or s-triazine derived ligands as catalysts for oxidations with organic peroxy acids and/or precursors of organic peroxy acids and h202 WIEPRECHT TORSTEN 2009-07-30 US disclosed
US-20090189119-A1 Use of metal complex compounds comprising pyridine pyrimidine or s-triazine derived ligands as catalysts for oxidations with organic peroxy acids and/or precursors of organic peroxy acids and h202 WIEPRECHT TORSTEN 2009-07-30 US disclosed
US-20090189119-A1 Use of metal complex compounds comprising pyridine pyrimidine or s-triazine derived ligands as catalysts for oxidations with organic peroxy acids and/or precursors of organic peroxy acids and h202 WIEPRECHT TORSTEN 2009-07-30 US disclosed
US-20090068282-A1 Use of metal complex compounds as oxidation catalysts CIBA SPECIALTY CHEMICALS CORPORATION 2009-03-12 US disclosed
US-7161005-B2 Use of metal complex compounds as oxidation catalysts CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-01-09 US disclosed
US-20060264633-A1 Use of metal complex compounds as oxidation catalysts SCHLINGLOFF GUNTHER 2006-11-23 US disclosed
US-20060247144-A1 USE OF METAL COMPLEX COMPOUNDS AS OXIDATION CATALYSTS RECKITT BENCKISER N.V. (NL) 2006-11-02 US disclosed
EP-1694807-A1 USE OF METAL COMPLEX COMPOUNDS AS OXIDATION CATALYSTS Reckitt Benckiser N.V. (NL) 2006-08-30 EP disclosed
EP-1383857-B1 USE OF METAL COMPLEX COMPOUNDS AS OXIDATION CATALYSTS CIBA SC HOLDING AG (CH) 2006-05-31 EP disclosed
US-20060100123-A1 Use of metal complex compounds as oxidation catalysts CIBA SPECIALTY CHEMICALS CORP. 2006-05-11 US disclosed
EP-1521820-B1 USE OF METAL COMPLEX COMPOUNDS AS OXIDATION CATALYSTS CIBA SC HOLDING AG (CH) 2006-03-22 EP disclosed
US-20060019853-A1 Use of metal complex compounds as catalysts for oxidation using molecular oxygen or air CIBA SPECIALTY CHEMICALS CORP. 2006-01-26 US disclosed
WO-2005061688-A1 USE OF METAL COMPLEX COMPOUNDS AS OXIDATION CATALYSTS RECKITT BENCKISER N.V. (NL) 2005-07-07 WO disclosed
US-20040142843-A1 Use of metal complex compounds as oxidation catalysts CIBA SPECIALTY CHEMICALS CORP. 2004-07-22 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 (3 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-20060264633-A1 Use of metal complex compounds as oxidation catalysts MICOS13, MLX, SOD1 L3MBTL1 690/4885ALDH1A1 4648/4885MAPT 4339/4885
US-20060019853-A1 Use of metal complex compounds as catalysts for oxidation using molecular oxygen or air COX14, MICOS13, OR10J3 L3MBTL1 3006/4885ALDH1A1 4208/4885MAPT 4366/4885
US-20090068282-A1 Use of metal complex compounds as oxidation catalysts MICOS13, MLX, SOD1 L3MBTL1 580/4885ALDH1A1 4632/4885MAPT 4354/4885

“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.