SCHEMBL243288

SCHEMBL243288

CS(=O)(=O)[O-].[Br+]

nearest known ligand 0.00

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ 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
SCHEMBL4858286 0.89 KDM4E (0.50)
SCHEMBL17065543 0.89 KDM4E (0.50)
SCHEMBL20570539 0.89
SCHEMBL23567016 0.89 KDM4E (0.50)
SCHEMBL22749162 0.89 KDM4E (0.50)
SCHEMBL23926540 0.89 KDM4E (0.50)
SCHEMBL22581617 0.89 KDM4E (0.50)
SCHEMBL20570026 0.89 KDM4E (0.50)
SCHEMBL20570963 0.89 KDM4E (0.50)
SCHEMBL1865619 0.89 KDM4E (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10328425-B2 Functionalized main chain polymers HAERING THOMAS (DE) 2019-06-25 US disclosed
US-20170266652-A1 FUNCTIONALIZED MAIN CHAIN POLYMERS HÄRING THOMAS (DE) 2017-09-21 US disclosed
US-20170095809-A1 FUNCTIONALIZED MAIN CHAIN POLYMERS HÄRING THOMAS (DE) 2017-04-06 US disclosed
US-20140155502-A1 FUNCTIONALIZED MAIN CHAIN POLYMERS Häring, Thomas (DE) 2014-06-05 US disclosed
US-8710175-B2 Functionalized main chain polymers Häring, Thomas (DE) 2014-04-29 US disclosed
US-20120004330-A1 FUNCTIONALIZED MAIN CHAIN POLYMERS HAERING THOMAS (DE) 2012-01-05 US disclosed
US-20100081783-A1 Functionalized Main Chain Polymers HARING THOMAS 2010-04-01 US disclosed
US-7615599-B2 Noncrosslinked, covalently crosslinked and/or ionically crosslinked polymer which can be used in direct methanol fuel cells; sulfonated polyetherketones and sulfonated polysulfones; acid doped polymer has high mechanical stability and a low permeability for hydrogen, oxygen and methanol HAERING THOMAS 2009-11-10 US disclosed
US-20070208153-A1 Functionalized Main Chain Polymers HARING THOMAS 2007-09-06 US disclosed
US-7196151-B2 Functionalized main chain polymers HAERING THOMAS 2007-03-27 US disclosed
US-20050124769-A1 Noncrosslinked, covalently crosslinked and/or ionically crosslinked polymer which can be used in direct methanol fuel cells; acid doped polymer has high mechanical stability and a low permeability for hydrogen, oxygen and methanol HARING THOMAS (DE) 2005-06-09 US disclosed