SCHEMBL9965292

SCHEMBL9965292

BC(O)(Br)C#C

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
SCHEMBL6854399 0.75
SCHEMBL822928 0.75
SCHEMBL9961903 0.69
SCHEMBL25343386 0.65
SCHEMBL5172041 0.65
SCHEMBL14272678 0.61
SCHEMBL11024745 0.61
SCHEMBL14500145 0.61
Benzene SCHEMBL9421890 0.59 ALDH1A1 (0.32)
SCHEMBL8629 0.58

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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8582192-B2 Polarizing photochromic articles TRANSITIONS OPTICAL, INC. (US) 2013-11-12 US disclosed
US-8545984-B2 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2013-10-01 US disclosed
US-8518546-B2 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2013-08-27 US disclosed
US-8236716-B2 Photochromic benzopyrano-benzopyrans with further fusing RODENSTOCK GMBH (DE) 2012-08-07 US disclosed
US-20120157677-A1 LACTONE COMPOUNDS AND MATERIALS MADE THEREFROM TRANSITIONS OPTICAL INC. (US) 2012-06-21 US disclosed
US-20120156508-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 US disclosed
US-20120157696-A1 METHOD OF MAKING INDENO-FUSED NAPHTHOL MATERIALS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 US disclosed
US-20120156521-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 US disclosed
US-20110279883-A1 POLARIZING PHOTOCHROMIC ARTICLES TRANSITIONS OPTICAL, INC. (US) 2011-11-17 US disclosed
US-20110201489-A1 PHOTOCHROMIC BENZOPYRANO-BENZOPYRANS WITH FURTHER FUSING RODENSTOCK GMBH (DE) 2011-08-18 US disclosed
US-20070098968-A1 Polarizing, photochromic devices and methods of making the same TRANSITIONS OPTICAL LIMITED (IE) 2007-05-03 US disclosed
US-20070075388-A1 Polarizing, photochromic devices and methods of making the same TRANSITIONS OPTICAL LIMITED (IE) 2007-04-05 US disclosed
US-20070053047-A1 Polarizing, photochromic devices and methods of making the same TRANSITIONS OPTICAL LIMITED (IE) 2007-03-08 US disclosed
US-20070053050-A1 Polarizing, photochromic devices and methods of making the same TRANSITIONS OPTICAL LIMITED (IE) 2007-03-08 US disclosed
US-20070053049-A1 Polarizing, photochromic devices and methods of making the same TRANSITIONS OPTICAL LIMITED (IE) 2007-03-08 US disclosed
US-20070053048-A1 Polirizing, photochromic devices and methods of making the same TRANSITIONS OPTICAL LIMITED (IE) 2007-03-08 US disclosed
US-20070047055-A1 Polarizing, photochromic devices and methods of making the same TRANSITIONS OPTICAL LIMITED (IE) 2007-03-01 US disclosed
US-20070047054-A1 Polarizing, photochromic devices and methods of making the same TRANSITIONS OPTICAL LIMITED (IE) 2007-03-01 US disclosed
US-20070047053-A1 Polarizing, photochromic devices and methods of making the same TRANSITIONS OPTICAL LIMITED (IE) 2007-03-01 US disclosed
US-20070041073-A1 Polarizing, photochromic devices and methods of making the same TRANSITIONS OPTICAL LIMITED (IE) 2007-02-22 US disclosed