SCHEMBL1071671

SCHEMBL1071671

FC(OCC1CO1)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
TSHR P16473 5/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
TP53 P04637 3/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
HIF1A Q16665 2/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 1/20 0.31
PPARG P37231 1/20 0.31
CYP3A4 P08684 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL6911632 0.93 ALDH1A1 (0.33) ALDH1A1TSHRMAPK1TDP1
SCHEMBL9513874 0.87 TSHR (0.35) ALDH1A1TSHRMAPK1TDP1TP53
SCHEMBL6243102 0.86 ALDH1A1 (0.33) ALDH1A1TSHRMAPK1TDP1
SCHEMBL711179 0.84 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1
SCHEMBL10943101 0.83 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1TDP1TP53
SCHEMBL711058 0.83 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1
SCHEMBL5077997 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL6396180 0.80 ALDH1A1 (0.30) ALDH1A1
SCHEMBL109265 0.80 ALDH1A1 (0.40) ALDH1A1TSHRMAPK1TDP1TP53
SCHEMBL709623 0.80 ALDH1A1 (0.34) ALDH1A1TSHRMAPK1TDP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324324-B2 Composition and process for preparing curable organofluorine-modified polysilazanes, and polysilazanes prepared thereby 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-12-04 US disclosed
EP-2449000-A1 COMPOSITION AND PROCESS FOR PREPARING CURABLE ORGANOFLUORINE-MODIFIED POLYSILAZANES, AND POLYSILAZANES PREPARED THEREBY 3M Innovative Properties Company (US) 2012-05-09 EP disclosed
WO-2011002666-A1 COMPOSITION AND PROCESS FOR PREPARING CURABLE ORGANOFLUORINE-MODIFIED POLYSILAZANES, AND POLYSILAZANES PREPARED THEREBY 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-01-06 WO disclosed
US-20100331498-A1 COMPOSITION AND PROCESS FOR PREPARING CURABLE ORGANOFLUORINE-MODIFIED POLYSILAZANES, AND POLYSILAZANES PREPARED THEREBY 3M INNOVATIVE PROPERTIES COMPANY 2010-12-30 US disclosed