SCHEMBL1962383

SCHEMBL1962383

C1=CC2=NC1=Cc1ccc([nH]1)C1=NC(=CC3=NC(=C2)C=C3)C=C1.[Fe]

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL12657677 0.89 — —
SCHEMBL2847937 0.71 — —
SCHEMBL3270945 0.70 — —
SCHEMBL15497944 0.69 — —
SCHEMBL180000 0.66 — —
Hydrochloric Acid SCHEMBL5165812 0.66 — —
SCHEMBL17459903 0.66 — —
SCHEMBL587850 0.66 — —
SCHEMBL10859923 0.65 — —
SCHEMBL4584235 0.64 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2192899-B1 TRANSITION METAL COMPLEXES OF CORROLES FOR PREVENTING CARDIOVASCULAR DISEASES OR DISORDERS TECHNION RES & DEV FOUNDATION (IL) 2014-10-01 — — EP disclosed
US-8791099-B2 Transition metal complexes of corroles for preventing cardiovascular diseases or disorders TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2014-07-29 — — US disclosed
US-20110144078-A1 TRANSITION METAL COMPLEXES OF CORROLES FOR PREVENTING CARDIOVASCULAR DISEASES OR DISORDERS TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2011-06-16 — — US disclosed
EP-2192899-A1 TRANSITION METAL COMPLEXES OF CORROLES FOR PREVENTING CARDIOVASCULAR DISEASES OR DISORDERS Technion Research and Development Foundation, Ltd. (IL) 2010-06-09 — — EP disclosed
WO-2009027965-A1 TRANSITION METAL COMPLEXES OF CORROLES FOR PREVENTING CARDIOVASCULAR DISEASES OR DISORDERS TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2009-03-05 — — WO disclosed
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