SCHEMBL7025626

SCHEMBL7025626

CCCCC1COC(C2CCC(c3cc(F)c(CCO)c(F)c3)CC2)OC1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.31

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
SCHEMBL7029079 0.97 SPHK1 (0.32) SPHK1
SCHEMBL7027851 0.93 CYP2C9 (0.32)
SCHEMBL7026499 0.86 SPHK1 (0.33) SPHK1
SCHEMBL7032816 0.86 ESR2 (0.35) SPHK1
SCHEMBL12396468 0.86
SCHEMBL7025624 0.84
SCHEMBL8387230 0.84
SCHEMBL13614937 0.84
SCHEMBL7023280 0.83
SCHEMBL7023946 0.83 SPHK1 (0.35) SPHK1

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