SCHEMBL757570

SCHEMBL757570

C#CC(O)(CC)C(F)(F)F

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
SCHEMBL8980426 0.76 TSHR (0.30)
SCHEMBL998630 0.74 AR (0.34)
SCHEMBL757468 0.72
SCHEMBL1445246 0.70 NR1H2 (0.32)
SCHEMBL9839908 0.70 CES1 (0.31)
SCHEMBL758316 0.67
SCHEMBL235810 0.65
SCHEMBL14890153 0.65
SCHEMBL979714 0.63
Meparfynol SCHEMBL12864498 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130005721-A1 INDOLIZINE INHIBITORS OF 5-LIPOXYGENASE PANMIRA PHARMACEUTICALS, LLC (US) 2013-01-03 US disclosed
US-20130005721-A1 INDOLIZINE INHIBITORS OF 5-LIPOXYGENASE PANMIRA PHARMACEUTICALS, LLC (US) 2013-01-03 US disclosed
US-20130005721-A1 INDOLIZINE INHIBITORS OF 5-LIPOXYGENASE PANMIRA PHARMACEUTICALS, LLC (US) 2013-01-03 US disclosed
US-20120214840-A1 INDOLIZINE INHIBITORS OF 5-LIPOXYGENASE PANMIRA PHARMACEUTICALS, LLC (US) 2012-08-23 US disclosed
US-20120214840-A1 INDOLIZINE INHIBITORS OF 5-LIPOXYGENASE PANMIRA PHARMACEUTICALS, LLC (US) 2012-08-23 US disclosed
US-20120214840-A1 INDOLIZINE INHIBITORS OF 5-LIPOXYGENASE PANMIRA PHARMACEUTICALS, LLC (US) 2012-08-23 US disclosed
EP-2480548-A2 INDOLIZINE INHIBITORS OF 5-LIPOXYGENASE Panmira Pharmaceuticals, LLC (US) 2012-08-01 EP disclosed
EP-2480547-A2 INDOLIZINE INHIBITORS OF 5-LIPOXYGENASE Panmira Pharmaceuticals, LLC (US) 2012-08-01 EP disclosed
EP-2118093-B1 [1,2,3]TRIAZOLYL SUBSTITUTED QUINOLINES AND COUMARINS AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS MERCK CANADA INC (CA) 2012-03-21 EP disclosed
WO-2011109679-A2 INHIBITORS OF 5-LIPOXYGENASE AMIRA PHARMACEUTICALS, INC. (US) 2011-09-09 WO disclosed
US-7960409-B2 e.g. 4-(3-fluorophenyl)-7-({4-[1-hydroxy-1-(trifluoromethyl)propyl]-1H-1,2,3-triazol-1-yl}methyl)-2H-chromen-2-one; leukotriene biosynthesis and 5-lipoxygenase (5-LO); inhibitor; antiatherosclerotic, antiasthmatic, antiallergic, antiinflammatory and cytoprotective agents MERCK SHARP & DOHME CORP. (US) 2011-06-14 US disclosed
WO-2011038097-A2 INDOLIZINE INHIBITORS OF 5-LIPOXYGENASE AMIRA PHARMACEUTICALS, INC. (US) 2011-03-31 WO disclosed
WO-2011038097-A2 INDOLIZINE INHIBITORS OF 5-LIPOXYGENASE AMIRA PHARMACEUTICALS, INC. (US) 2011-03-31 WO disclosed
WO-2011038086-A2 INDOLIZINE INHIBITORS OF 5-LIPOXYGENASE AMIRA PHARMACEUTICALS, INC. (US) 2011-03-31 WO disclosed
WO-2011038086-A2 INDOLIZINE INHIBITORS OF 5-LIPOXYGENASE AMIRA PHARMACEUTICALS, INC. (US) 2011-03-31 WO disclosed
WO-2008095292-A1 [1,2,3] TRIAZOLYL SUBSTITUTED QUINOLINES AND COUMARINS AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS MERCK FROSST CANADA LTD. (CA) 2008-08-14 WO disclosed
US-20080188521-A1 e.g. 4-(3-fluorophenyl)-7-({4-[1-hydroxy-1-(trifluoromethyl)propyl]-1H-1,2,3-triazol-1-yl}methyl)-2H-chromen-2-one; leukotriene biosynthesis and 5-lipoxygenase (5-LO); inhibitor; antiatherosclerotic, antiasthmatic, antiallergic, antiinflammatory and cytoprotective agents MERCK CANADA INC. (CA) 2008-08-07 US disclosed
EP-1915369-A1 NOVEL SUBSTITUTED 1,2,3-T II AZOLYLMETHYL-BENZOTHIOPHENE OR -INDOLE AND THEIR USE AS LEUKOTIIENE BIOSYNTHESIS INHIBITORS Merck Frosst Canada Ltd. (CA) 2008-04-30 EP disclosed
WO-2007016784-A1 NOVEL SUBSTITUTED 1,2,3-TΠAZOLYLMETHYL-BENZOTHIOPHENE OR -INDOLE AND THEIR USE AS LEUKOTΠENE BIOSYNTHESIS INHIBITORS MERCK FROSST CANADA LTD. (CA) 2007-02-15 WO disclosed
WO-2007016784-A1 NOVEL SUBSTITUTED 1,2,3-TΠAZOLYLMETHYL-BENZOTHIOPHENE OR -INDOLE AND THEIR USE AS LEUKOTΠENE BIOSYNTHESIS INHIBITORS MERCK FROSST CANADA LTD. (CA) 2007-02-15 WO disclosed