SCHEMBL1479810

SCHEMBL1479810

FC(F)(F)c1ccc(-c2ccc3c(c2)Cc2cc(-c4ccc(C(F)(F)F)cc4)ccc2-3)cc1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 2/20 0.68
KIF11 P52732 10/20 0.51
ESR1 P03372 1/20 0.51
ESR2 Q92731 1/20 0.51
HRH3 Q9Y5N1 1/20 0.46
CHRNB2 P17787 1/20 0.45
CHRNA4 P43681 1/20 0.45
PARP10 Q53GL7 1/20 0.42
PARP11 Q9NR21 1/20 0.42
ASIC3 Q9UHC3 1/20 0.41
AGXT P21549 1/20 0.41

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
SCHEMBL1482504 0.91 TDP2 (0.59) TDP2KIF11ESR1ESR2HRH3
SCHEMBL33527314 0.85 TDP2 (0.59) TDP2KIF11ESR1ESR2PARP10
SCHEMBL13358883 0.83 KIF11 (0.52) TDP2KIF11ESR1ESR2AGXT
SCHEMBL5684062 0.83 TDP2 (0.51) TDP2KIF11ESR1ESR2HRH3
SCHEMBL1482395 0.83 TDP2 (0.51) TDP2KIF11ESR1ESR2HRH3
SCHEMBL18010842 0.82 TDP2 (1.00) TDP2KIF11
SCHEMBL1904799 0.82 KIF11 (0.50) TDP2KIF11ESR1ESR2
SCHEMBL1482704 0.78 CYP3A4 (0.51) TDP2ESR1ESR2HRH3
SCHEMBL4893296 0.78 TDP2 (0.57) TDP2KIF11HRH3CHRNB2CHRNA4
SCHEMBL197238 0.76 KIF11 (0.78) KIF11

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
US-8293856-B2 Process for preparing olefin polymer using mixed catalyst MITSUI CHEMICALS, INC. (JP) 2012-10-23 US disclosed
US-20110077369-A1 PROCESS FOR PREPARING OLEFIN POLYMER USING MIXED CATALYST MITSU CHEMICALS, INC. 2011-03-31 US disclosed