SCHEMBL4960586

SCHEMBL4960586

O=[C]C(CCCl)c1cc(F)c(F)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34

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
SCHEMBL909305 0.73 CES2 (0.41) CES2CES1
SCHEMBL909581 0.73 CES2 (0.41) CES2CES1
Hydrochloric Acid SCHEMBL909583 0.71 CES2 (0.40) CES2CES1
SCHEMBL4960589 0.70 CES2 (0.34) CES2CES1
Hydrochloric Acid SCHEMBL909364 0.67 CES2 (0.36) CES2CES1
SCHEMBL909183 0.67 CES2 (0.39) CES2CES1
SCHEMBL961452 0.63 CES2 (0.39) CES2CES1
SCHEMBL1533438 0.62 CES2 (0.32) CES2CES1
SCHEMBL1533366 0.60
SCHEMBL23527683 0.58 MIF (0.36) CES2CES1

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-1992618-A1 POLYCYCLIC CINNAMIDE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2008-11-19 EP disclosed