SCHEMBL3825835

SCHEMBL3825835

CC1=CCC(=S)C=C1

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
SCHEMBL51118 0.71
SCHEMBL1493104 0.69
SCHEMBL9262395 0.67
SCHEMBL1406158 0.67
SCHEMBL22265038 0.67
SCHEMBL4622061 0.67
SCHEMBL3752206 0.67
SCHEMBL18943024 0.65
SCHEMBL9357249 0.65
SCHEMBL30058644 0.65

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-7635685-B2 Bifunctional antibiotics for targeting rRNA and resistance-causing enzymes and for inhibition of anthrax lethal factor TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2009-12-22 US claimed
US-20050148522-A1 Bifunctional antibiotics for targeting rRNA and resistance-causing enzymes and for inhibition of anthrax lethal factor TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. 2005-07-07 US claimed
US-20050004052-A1 Bifunctional antibiotics for targeting rRNA and resistance-causing enzymes TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. 2005-01-06 US claimed
US-8968997-B2 Benzoxazole-based fluorescent metal ion indicators Life Technologies Corporation (US) 2015-03-03 US disclosed
US-20140045171-A1 BENZOXAZOLE-BASED FLUORESCENT METAL ION INDICATORS Life Technologies Corporation (US) 2014-02-13 US disclosed
US-8540521-B2 Benzoxazole-based fluorescent metal ion indicators Life Technologies Corporation (US) 2013-09-24 US disclosed
US-20110306082-A1 \"BENZOXAZOLE-BASED FLUORESCENT METAL ION INDICATORS\ Life Technologies Corporation (US) 2011-12-15 US disclosed
US-7635685-B2 Bifunctional antibiotics for targeting rRNA and resistance-causing enzymes and for inhibition of anthrax lethal factor TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2009-12-22 US disclosed
EP-1789429-B1 BIFUNCTIONAL ANTIBIOTICS FOR TARGETING RRNA AND RESISTANCE CAUSING ENZYMES AND FOR INHIBITION OF ANTHRAX LETHAL FACTOR TECHNION RES & DEV FOUNDATION (IL) 2009-08-26 EP disclosed
US-20050148522-A1 Bifunctional antibiotics for targeting rRNA and resistance-causing enzymes and for inhibition of anthrax lethal factor TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. 2005-07-07 US disclosed
US-20050004052-A1 Bifunctional antibiotics for targeting rRNA and resistance-causing enzymes TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. 2005-01-06 US disclosed
CN-1090709-A Bromine third phosphorus-parathion-methyl emulsion INST OF PLANT PROTECTION CHINE (CN) 1994-08-17 CN disclosed