SCHEMBL7555404

SCHEMBL7555404

[CH2]CCCCCCCCCS(=O)(=O)CCCC(F)(F)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CES1 P23141 5/20 0.36
FAAH O00519 3/20 0.33
CES2 O00748 2/20 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
SCHEMBL7552918 1.00 CES1 (0.36) CES1FAAHCES2
SCHEMBL7558998 1.00 CES1 (0.36) CES1FAAHCES2
SCHEMBL7555490 1.00 CES1 (0.36) CES1FAAHCES2
SCHEMBL7551508 1.00 CES1 (0.36) CES1FAAHCES2
SCHEMBL7553254 1.00 CES1 (0.36) CES1FAAHCES2
SCHEMBL14775555 0.85 CES1 (0.35) CES1FAAHCES2
SCHEMBL14775193 0.83 CES1 (0.38) CES1FAAHCES2
SCHEMBL7559579 0.82 CES1 (0.37) CES1FAAHCES2
SCHEMBL7552607 0.82 CES1 (0.37) CES1FAAHCES2
SCHEMBL7058118 0.82 CES1 (0.37) CES1FAAHCES2

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-1219631-A1 ANTIANDROGEN AGENTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-07-03 EP disclosed