SCHEMBL4855848

SCHEMBL4855848

O=C([O-])C(Cl)(C(F)(F)F)C(F)(F)F.O=C([O-])C(Cl)(C(F)(F)F)C(F)(F)F.[Mg+2]

nearest known ligand 0.00

Known targets — ChEMBL curated mechanism

ATP4AATP4BGABBR1GABBR2HMGCR

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
SCHEMBL4848603 0.94
Potassium Ion SCHEMBL4856012 0.94 CA4 (0.35)
SCHEMBL4854298 0.94 CA4 (0.33)
SCHEMBL4855381 0.78 CA4 (0.33)
SCHEMBL4853875 0.77
SCHEMBL6119631 0.71
Potassium Ion SCHEMBL4855237 0.71
SCHEMBL4848010 0.71 CA4 (0.33)
Silver SCHEMBL11855500 0.71
Potassium Ion SCHEMBL11609221 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7414148-B2 Process for producing alkoxycarbonylfluoroalkanesulfonates CENTRAL GLASS COMPANY LIMITED (JP) 2008-08-19 US disclosed
US-20080108846-A1 PROCESS FOR PRODUCING ALKOXYCARBONYLFLUOROALKANESULFONATES CENTRAL GLASS COMPANY, LIMITED (JP) 2008-05-08 US disclosed