SCHEMBL7031003

SCHEMBL7031003

C=CCC[C@H]1CO[C@H](c2ccc(-c3ccc(COC)c(F)c3)cc2)OC1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 7/20 0.32
FAAH O00519 1/20 0.31
ABCB1 P08183 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
SCHEMBL7026161 0.89
SCHEMBL7027891 0.86 NAAA (0.34) NAAAFAAHABCB1
SCHEMBL7028530 0.86 NAAA (0.34) NAAAFAAHABCB1
SCHEMBL7031004 0.85
SCHEMBL7028215 0.84 ESR2 (0.35) NAAAFAAHABCB1
SCHEMBL8387920 0.84 NAAA (0.34) NAAA
SCHEMBL7026091 0.83 ESR2 (0.34) NAAAFAAHABCB1
SCHEMBL7027471 0.83 ESR2 (0.33) NAAAFAAHABCB1
SCHEMBL20803592 0.82 KDM1A (0.41) NAAA
SCHEMBL12655835 0.80

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0754668-B1 Fluorobenzylether derivatives ROLIC AG (CH) 2003-02-05 EP disclosed
EP-0754668-A2 Fluorobenzylether derivatives Rolic AG (CH) 1997-01-22 EP disclosed