SCHEMBL1498656

SCHEMBL1498656

CC=CC=C[S]

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
SCHEMBL1498654 1.00
SCHEMBL425874 0.76
SCHEMBL1760717 0.76
SCHEMBL1760673 0.76
SCHEMBL5328842 0.76
SCHEMBL27683 0.76
SCHEMBL110025 0.76
SCHEMBL13083556 0.71
SCHEMBL6201791 0.71 ALDH1A1 (0.61)
Hydrochloric Acid SCHEMBL21610957 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9187690-B2 Rare earth metal complex having phenanthroline compound as ligand B.R.A.H.M.S. GMBH (DE) 2015-11-17 US disclosed
EP-2683725-B1 RARE EARTH METAL COMPLEX HAVING PHENANTHROLINE COMPOUND AS LIGAND BRAHMS GMBH (DE) 2015-08-26 EP disclosed
EP-2477986-B1 PHENANTHROLINE DERIVATIVES AND THEIR USE AS LIGANDS BRAHMS GMBH (DE) 2014-11-12 EP disclosed
US-20140058073-A1 RARE EARTH METAL COMPLEX HAVING PHENANTHROLINE COMPOUND AS LIGAND B.R.A.H.M.S. GMBH (DE) 2014-02-27 US disclosed
US-8648194-B2 Compounds having phenanthroline structure B.R.A.H.M.S GMBH (DE) 2014-02-11 US disclosed
EP-2683725-A1 RARE EARTH METAL COMPLEX HAVING PHENANTHROLINE COMPOUND AS LIGAND B.R.A.H.M.S GmbH (DE) 2014-01-15 EP disclosed
US-20120277238-A1 PHARMACEUTICAL COMPOSITION CONTAINING FUSED HETERO-RING DERIVATIVE SHIONOGI & CO., LTD (JP) 2012-11-01 US disclosed
US-20120238748-A1 NOVEL COMPOUNDS HAVING PHENANTHROLINE STRUCTURE B.R.A.H.M.S GMBH (DE) 2012-09-20 US disclosed
WO-2012124310-A1 RARE EARTH METAL COMPLEX HAVING PHENANTHROLINE COMPOUND AS LIGAND B.R.A.H.M.S GMBH (DE) 2012-09-20 WO disclosed
EP-2477986-A1 PHENANTHROLINE DERIVATIVES AND THEIR USE AS LIGANDS B.R.A.H.M.S GmbH (DE) 2012-07-25 EP disclosed
EP-2460794-A1 PHARMACEUTICAL COMPOSITION CONTAINING FUSED HETERO-RING DERIVATIVE Shionogi & Co., Ltd. (JP) 2012-06-06 EP disclosed
WO-2011030566-A1 PHENANTHROLINE DERIVATIVES AND THEIR USE AS LIGANDS EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-03-17 WO disclosed