SCHEMBL8769618

SCHEMBL8769618

CCCCCCOC(COCC)(OC)OCC.O=S(=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
CES1 P23141 1/20 0.35
CES2 O00748 1/20 0.33

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
SCHEMBL8769243 0.81 CES1 (0.33) CES1CES2
SCHEMBL8769246 0.75 CES1 (0.42) CES1CES2
SCHEMBL23581441 0.72 F2 (0.38) CES1CES2
SCHEMBL8769249 0.71 CES1 (0.35) CES1CES2
SCHEMBL8769629 0.71 CES1 (0.35) CES1CES2
SCHEMBL8769624 0.70 PLA2G2C (0.35) CES1CES2
SCHEMBL28358920 0.69 CES1 (0.37) CES1CES2
Octadecylamine SCHEMBL19743165 0.69 DNM1 (0.43) CES1CES2
Tetrahexylammonium SCHEMBL238607 0.69 SLC22A1 (0.43) CES1
SCHEMBL11437791 0.69 RECQL (0.46) CES1CES2

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