SCHEMBL8769302

SCHEMBL8769302

CCCCOCCOC(F)CCCOS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA1 P00915 7/20 0.35
CA2 P00918 7/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL8769294 0.85 TSHR (0.32) CA1CA2
SCHEMBL8769279 0.84 CA1 (0.41) CA1CA2
SCHEMBL9047614 0.84 CA1 (0.41) CA1CA2
SCHEMBL4456004 0.81 CA2 (0.47) CA1CA2
SCHEMBL1932935 0.77 CA1 (0.46) CA1CA2
SCHEMBL9047624 0.76 CA1 (0.39) CA1CA2
SCHEMBL11626216 0.75 CA2 (0.47) CA1CA2
SCHEMBL27877423 0.74 CA2 (0.46) CA1CA2
SCHEMBL27908673 0.74 CA2 (0.46) CA1CA2
SCHEMBL8769287 0.73 CA1 (0.37) CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0792255-A1 LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-09-03 EP disclosed