SCHEMBL14699600

SCHEMBL14699600

CCC(C)CC(C(=O)OCCc1ccc(OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1)C(C)(CC)CC

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
PPARA Q07869 5/20 0.31
PPARD Q03181 3/20 0.31
PPARG P37231 3/20 0.31
STS P08842 1/20 0.30

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
SCHEMBL13823229 0.84 CA1 (0.35) CA1CA2
SCHEMBL13024727 0.84 CA1 (0.40) CA1CA2PPARAPPARDPPARG
SCHEMBL13800884 0.82 CA1 (0.36) CA1CA2PPARAPPARDPPARG
SCHEMBL13802540 0.81 CA1 (0.41) CA1CA2PPARAPPARDPPARG
SCHEMBL13024731 0.81 CA1 (0.42) CA1CA2PPARAPPARDPPARG
SCHEMBL13125197 0.81 CA1 (0.42) CA1CA2PPARAPPARDPPARG
SCHEMBL13024728 0.81 CA1 (0.42) CA1CA2PPARAPPARDPPARG
SCHEMBL13024736 0.80 CA1 (0.45) CA1CA2PPARAPPARDPPARG
SCHEMBL14699595 0.79 CA1 (0.32) CA1CA2PPARAPPARDPPARG
SCHEMBL13823127 0.78 CA1 (0.39) CA1CA2PPARAPPARDPPARG

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-2071404-B1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY, METHOD FOR PRODUCING ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC DEVICE CANON KK (JP) 2013-02-13 EP disclosed