SCHEMBL6065331

SCHEMBL6065331

OB(O)c1c(F)c(F)c(F)c(F)c1F.OB(O)c1cc(F)cc(F)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA9 Q16790 1/20 0.35
ORAI1 Q96D31 1/20 0.31
ORAI2 Q96SN7 1/20 0.31
ORAI3 Q9BRQ5 1/20 0.31
TRPV6 Q9H1D0 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 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
SCHEMBL124847 0.85 CA1 (0.45) CA12CA1CA9ORAI1ORAI2
SCHEMBL125669 0.77
SCHEMBL28054317 0.74
SCHEMBL19124550 0.74
SCHEMBL31633557 0.74
SCHEMBL18462880 0.73 CA12 (0.33) CA12CA1CA9
SCHEMBL29249836 0.73 CA12 (0.35) CA12CA1CA9ORAI1ORAI2
SCHEMBL675958 0.71 CA12 (0.57) CA12CA1CA9ORAI1ORAI2
SCHEMBL5498474 0.71
SCHEMBL28824846 0.70 ENPP2 (0.33) CA1ORAI1ORAI2ORAI3TRPV6

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-1640385-A2 Process for preparing low molecular weight olefin (co)polymer and polymerizing catalyst used therefor MITSUI CHEMICALS, INC. (JP) 2006-03-29 EP disclosed
EP-1416000-A1 Process for preparing low molecular weight olefin (co)polymer and polymerizing catalyst used therefor Mitsui Chemicals, Inc. (JP) 2004-05-06 EP disclosed