SCHEMBL684629

SCHEMBL684629

O=C1C=C(Br)/C(=C/O)N1

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
Water SCHEMBL27943909 0.65
SCHEMBL6138613 0.56
SCHEMBL6332789 0.56
SCHEMBL15223659 0.54
Formic Acid SCHEMBL27800193 0.53 GSK3A (0.69)
SCHEMBL12276842 0.53 GSK3A (0.41)
SCHEMBL14602375 0.52
SCHEMBL1029298 0.52
SCHEMBL9587810 0.49 GSK3B (0.37)
SCHEMBL12481392 0.49 PTPRC (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2177226-B1 Hydroxamate compositions COVIDIEN LP (US) 2013-09-18 EP disclosed
US-8425972-B2 Antimicrobial materials and coatings COVIDIEN LP (US) 2013-04-23 US disclosed
US-8425972-B2 Antimicrobial materials and coatings COVIDIEN LP (US) 2013-04-23 US disclosed
EP-2564859-A1 Hydroxamate compositions Covidien LP (US) 2013-03-06 EP disclosed
US-8153741-B2 Furanone copolymers TYCO HEALTHCARE GROUP LP (US) 2012-04-10 US disclosed
US-8153741-B2 Furanone copolymers TYCO HEALTHCARE GROUP LP (US) 2012-04-10 US disclosed
US-20110280824-A1 Furanone Copolymers TYCO HEALTHCARE GROUP LP (US) 2011-11-17 US disclosed
US-20110280824-A1 Furanone Copolymers TYCO HEALTHCARE GROUP LP (US) 2011-11-17 US disclosed
US-7999051-B2 Furanone copolymers TYCO HEALTHCARE GROUP LP (US) 2011-08-16 US disclosed
US-7999051-B2 Furanone copolymers TYCO HEALTHCARE GROUP LP (US) 2011-08-16 US disclosed
US-7923439-B2 Hydroxamate compositions TYCO HEALTHCARE GROUP LP (US) 2011-04-12 US disclosed
US-7923439-B2 Hydroxamate compositions TYCO HEALTHCARE GROUP LP (US) 2011-04-12 US disclosed
US-20100130713-A1 FURANONE COPOLYMERS COVIDIEN LP 2010-05-27 US disclosed
US-20100130713-A1 FURANONE COPOLYMERS COVIDIEN LP 2010-05-27 US disclosed
US-20100119695-A1 ANTIMICROBIAL MATERIALS AND COATINGS COVIDIEN LP 2010-05-13 US disclosed
US-20100119695-A1 ANTIMICROBIAL MATERIALS AND COATINGS COVIDIEN LP 2010-05-13 US disclosed
EP-2177226-A1 Hydroxamate compositions Tyco Healthcare Group LP (US) 2010-04-21 EP disclosed
US-20100093846-A1 HYDROXAMATE COMPOSITIONS TYCO HEALTHCARE GROUP LP 2010-04-15 US disclosed
US-20100093846-A1 HYDROXAMATE COMPOSITIONS TYCO HEALTHCARE GROUP LP 2010-04-15 US disclosed
WO-2008144247-A1 ANTIMICROBIAL MATERIALS AND COATINGS TYCO HEALTHCARE GROUP LP (US) 2008-11-27 WO disclosed