SCHEMBL30119953

SCHEMBL30119953

CCCC=CCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.36
CES1 P23141 2/20 0.36
PLA2G4A P47712 2/20 0.34
ALDH1A1 P00352 1/20 0.34
PLA2G4B P0C869 1/20 0.34
MAPT P10636 1/20 0.34
BLM P54132 1/20 0.34
MGLL Q99685 1/20 0.34
PLA2G4C Q9UP65 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
SCHEMBL27429945 0.90 THRB (0.31)
SCHEMBL30120072 0.85 FAAH (0.36) FAAHCES1PLA2G4AALDH1A1PLA2G4B
SCHEMBL29180731 0.84 FAAH (0.42) FAAHCES1PLA2G4AALDH1A1PLA2G4B
SCHEMBL30119918 0.83 ALDH1A1 (0.33) FAAHCES1PLA2G4AALDH1A1PLA2G4B
SCHEMBL1703745 0.79 LMNA (0.32)
SCHEMBL17549723 0.79 LMNA (0.32)
SCHEMBL17549734 0.79 LMNA (0.32)
SCHEMBL13354524 0.79 LMNA (0.32)
SCHEMBL1703747 0.79 LMNA (0.32)
SCHEMBL2483152 0.79 LMNA (0.32)

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-3638643-B1 PROCESS FOR THE PREPARATION OF SEMIFLUORINATED ALKANES USING GRIGNARD REAGENTS NOVALIQ GMBH (DE) 2023-01-18 EP disclosed