SCHEMBL2532995

SCHEMBL2532995

O=C(CC(=O)c1cc(N2CCCC2)ccn1)CC(=O)c1cc(N2CCCC2)ccn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.52
▸ MAPT P10636 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ KLF5 Q13887 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ HRH4 Q9H3N8 5/20 0.42
▸ CHKA P35790 1/20 0.41
▸ LNPEP Q9UIQ6 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ ELOVL1 Q9BW60 1/20 0.39
▸ CTSA P10619 1/20 0.39

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
SCHEMBL30489430 0.81 USP30 (0.47) USP30MAPTNPC1PKMHTT
SCHEMBL2533014 0.81 ALDH1A1 (0.51) USP30MAPTNPC1PKMHTT
SCHEMBL10098376 0.80 KDM4E (0.50) USP30MAPTNPC1PKMHTT
SCHEMBL14882630 0.79 USP30 (0.52) USP30MAPTNPC1PKMHTT
Hydrochloric Acid SCHEMBL14876289 0.78 KDM4E (0.49) USP30MAPTNPC1PKMHTT
SCHEMBL18135099 0.78 NFKB1 (0.51) USP30MAPTNPC1PKMHTT
SCHEMBL2539328 0.75 NPC1 (0.48) USP30MAPTNPC1PKMHTT
SCHEMBL14877354 0.75 USP30 (0.46) USP30MAPTNPC1PKMHTT
SCHEMBL18135111 0.75 HRH4 (0.48) USP30MAPTNPC1PKMHTT
SCHEMBL12720868 0.74 USP30 (0.48) USP30MAPTNPC1PKMHTT

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 25 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-20080262225-A1 Use of metal complex compounds as oxidation catalysts SCHLINGLOFF GUNTHER 2008-10-23 — — US disclosed
US-20080262225-A1 Use of metal complex compounds as oxidation catalysts SCHLINGLOFF GUNTHER 2008-10-23 — — US disclosed
US-20080262225-A1 Use of metal complex compounds as oxidation catalysts SCHLINGLOFF GUNTHER 2008-10-23 — — US disclosed
US-7161005-B2 Use of metal complex compounds as oxidation catalysts CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-01-09 — — US disclosed
US-7161005-B2 Use of metal complex compounds as oxidation catalysts CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-01-09 — — 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
EP-1383857-B1 USE OF METAL COMPLEX COMPOUNDS AS OXIDATION CATALYSTS CIBA SC HOLDING AG (CH) 2006-05-31 — — 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
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 (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-20060264633-A1 Use of metal complex compounds as oxidation catalysts MICOS13, MLX, SOD1 USP30 3490/4885MAPT 4339/4885NPC1 1281/4885
US-20060019853-A1 Use of metal complex compounds as catalysts for oxidation using molecular oxygen or air COX14, MICOS13, OR10J3 USP30 4192/4885MAPT 4366/4885NPC1 1005/4885
US-20080262225-A1 Use of metal complex compounds as oxidation catalysts MICOS13, MLX, RPL13 USP30 3654/4885MAPT 4312/4885NPC1 1458/4885
US-20090068282-A1 Use of metal complex compounds as oxidation catalysts MICOS13, MLX, SOD1 USP30 3661/4885MAPT 4354/4885NPC1 1390/4885

“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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