SCHEMBL2545683

SCHEMBL2545683

c1ccc(-c2cc(N3CCOCC3)c3ccccc3n2)nc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 16/20 1.00
ALOX15 P16050 1/20 0.62
MAPK1 P28482 1/20 0.62
NCF1 P14598 2/20 0.61
MOK Q9UQ07 1/20 0.55

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
SCHEMBL31310819 0.88 METAP1 (0.97) METAP1MAPK1NCF1
SCHEMBL2551229 0.88 METAP1 (0.97) METAP1MAPK1NCF1
SCHEMBL2547815 0.86 METAP1 (1.00) METAP1MAPK1NCF1
SCHEMBL31310818 0.86 METAP1 (1.00) METAP1MAPK1NCF1
SCHEMBL19475328 0.78 NCF1 (0.67) METAP1MAPK1NCF1MOK
SCHEMBL14478814 0.78 MOK (0.65) METAP1MAPK1NCF1MOK
SCHEMBL2542173 0.77 METAP1 (0.63) METAP1ALOX15MAPK1
SCHEMBL4733419 0.76 NCF1 (0.74) METAP1MAPK1NCF1MOK
SCHEMBL4733334 0.76 NCF1 (1.00) METAP1NCF1MOK
SCHEMBL5093588 0.76 NCF1 (1.00) METAP1MAPK1NCF1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993470-B2 Catalysts for the alkyne metathesis STUDIENGESELLSCHAFT KOHLE MBH (DE) 2015-03-31 US claimed
EP-2556078-B1 CATALYSTS FOR ALKYNE METATHESIS STUDIENGESELLSCHAFT KOHLE MBH (DE) 2014-09-24 EP claimed
US-20130144102-A1 CATALYSTS FOR THE ALKYNE METATHESIS STUDIENGESELLSCHAFT KOHLE MBH (DE) 2013-06-06 US claimed
EP-2556078-A1 CATALYSTS FOR ALKYNE METATHESIS Studiengesellschaft Kohle MbH (DE) 2013-02-13 EP claimed
WO-2011120508-A1 CATALYSTS FOR ALKYNE METATHESIS STUDIENGESELLSCHAFT KOHLE MBH (DE) 2011-10-06 WO claimed
WO-2025003315-A1 POLYMERIZABLE COMPOSITION OF CYCLIC OLEFINIC MONOMERS AND ASSOCIATED RING-OPENING METATHESIS POLYMERIZATION PROCESS TELENE SAS (FR) 2025-01-02 WO disclosed
EP-4484463-A1 POLYMERIZABLE COMPOSITION OF CYCLIC OLEFINIC MONOMERS AND ASSOCIATED RING-OPENING METATHESIS POLYMERIZATION PROCESS Telene SAS (FR) 2025-01-01 EP disclosed
US-9233362-B2 Molybdenum and tungsten metal complexes and use thereof as precatalysts for olefin metathesis STUDIENGESELLSCHAFT KOHLE MBH (DE) 2016-01-12 US disclosed
EP-2680967-B1 MOLYBDENUM AND TUNGSTEN METAL COMPLEXES AND USE THEREOF AS PRECATALYSTS FOR OLEFIN METATHESIS STUDIENGESELLSCHAFT KOHLE MBH (DE) 2015-05-13 EP disclosed
US-8993470-B2 Catalysts for the alkyne metathesis STUDIENGESELLSCHAFT KOHLE MBH (DE) 2015-03-31 US disclosed
US-20140296516-A1 MOLYBDENUM AND TUNGSTEN METAL COMPLEXES AND USE THEREOF AS PRECATALYSTS FOR OLEFIN METATHESIS STUDIENGESELLSCHAFT KOHLE MBH (DE) 2014-10-02 US disclosed
EP-2556078-B1 CATALYSTS FOR ALKYNE METATHESIS STUDIENGESELLSCHAFT KOHLE MBH (DE) 2014-09-24 EP disclosed
EP-2680967-A1 MOLYBDENUM AND TUNGSTEN METAL COMPLEXES AND USE THEREOF AS PRECATALYSTS FOR OLEFIN METATHESIS Studiengesellschaft Kohle MbH (DE) 2014-01-08 EP disclosed
US-20130144102-A1 CATALYSTS FOR THE ALKYNE METATHESIS STUDIENGESELLSCHAFT KOHLE MBH (DE) 2013-06-06 US disclosed
WO-2012116695-A1 MOLYBDENUM AND TUNGSTEN METAL COMPLEXES AND USE THEREOF AS PRECATALYSTS FOR OLEFIN METATHESIS STUDIENGESELLSCHAFT KOHLE MBH (DE) 2012-09-07 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 (2 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-20140296516-A1 MOLYBDENUM AND TUNGSTEN METAL COMPLEXES AND USE THEREOF AS PRECATALYSTS FOR OLEFIN METATHESIS MSRB3, RO60, RTF1 METAP1 2284/4885ALOX15 805/4885MAPK1 1727/4885
US-20130144102-A1 CATALYSTS FOR THE ALKYNE METATHESIS MSH6, AP3M1, PMS2 METAP1 259/4885ALOX15 806/4885MAPK1 3551/4885

“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.