SCHEMBL7029902

SCHEMBL7029902

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

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 13/20 0.33
FAAH O00519 1/20 0.32
ABCB1 P08183 1/20 0.31
GBA1 P04062 2/20 0.30
LCT P09848 2/20 0.30
UGCG Q16739 2/20 0.30
GBA2 Q9HCG7 2/20 0.30
MGAM O43451 1/20 0.30
SI P14410 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
SCHEMBL7025546 0.88
SCHEMBL7028530 0.87 NAAA (0.34) NAAAFAAHABCB1GBA1LCT
SCHEMBL7029907 0.85 RORC (0.30)
SCHEMBL8972505 0.84 CYP11B2 (0.33)
SCHEMBL9312426 0.84 CYP11B2 (0.33)
SCHEMBL9312429 0.84 CYP11B2 (0.33)
SCHEMBL8972512 0.84 CYP11B2 (0.33)
SCHEMBL8972309 0.81 FFAR1 (0.32)
SCHEMBL9311912 0.81 FFAR1 (0.32)
SCHEMBL9311904 0.81 FFAR1 (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 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