SCHEMBL692843

SCHEMBL692843

C=CCP(=O)([O-])CC=C.C=CCP(=O)([O-])CC=C.[Ca+2]

nearest known ligand 0.00

Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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
Potassium Ion SCHEMBL18203957 0.94 SLC34A1 (0.32)
SCHEMBL3853858 0.94
SCHEMBL2546204 0.75
SCHEMBL2540635 0.75
SCHEMBL2543713 0.75
SCHEMBL2545706 0.75
Lithium Ion SCHEMBL2542181 0.75
Potassium Ion SCHEMBL2538052 0.75
SCHEMBL28687853 0.71
Potassium Ion SCHEMBL1170244 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1967549-B1 USE OF A FLAME-RETARDANT RESIN COMPOSITION FOR TRANSMISSION SIDE MEMBER IN LASER WELDING WINTECH POLYMER LTD (JP) 2012-02-29 EP disclosed
US-20100233474-A1 FLAME-RETARDANT RESIN COMPOSITION FORMING LASER-TRANSMITTABLE MEMBER WINTECH POLYMER LTD. (JP) 2010-09-16 US disclosed
US-7612131-B2 Flame-retardant resin composition WINTECH POLYMER LTD. (JP) 2009-11-03 US disclosed
EP-1967549-A1 FLAME-RETARDANT RESIN COMPOSITION FOR TRANSMISSION SIDE MEMBER IN LASER WELDING Wintech Polymer Ltd. (JP) 2008-09-10 EP disclosed
US-20080167406-A1 FLAME-RETARDANT RESIN COMPOSITION WINTECH POLYMER, LTD. (JP) 2008-07-10 US disclosed
EP-1935944-A2 Flame-retardant resin composition Wintech Polymer Ltd. (JP) 2008-06-25 EP disclosed