SCHEMBL4566185

SCHEMBL4566185

C=CC(=O)OCCCC=CF

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.61
ALDH1A1 P00352 5/20 0.61
CYP3A4 P08684 2/20 0.61
TP53 P04637 3/20 0.55
HIF1A Q16665 3/20 0.55
HSD17B10 Q99714 1/20 0.55
HPGD P15428 1/20 0.55
THRB P10828 2/20 0.42
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ATM Q13315 1/20 0.35
MAPT P10636 1/20 0.33
HCAR2 Q8TDS4 3/20 0.32

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
SCHEMBL3416382 0.94 TSHR (0.64) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL6530911 0.88 TSHR (0.59) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL28721880 0.81 TSHR (0.57) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL48743 0.81 TSHR (0.61) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL13945620 0.80 TSHR (0.79) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL865155 0.79 TSHR (0.71) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL4623390 0.79 TSHR (0.75) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL6053929 0.79 TSHR (0.63) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL28578393 0.79 TSHR (0.59) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL321925 0.79 TSHR (0.85) TSHRALDH1A1CYP3A4TP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7615592-B2 Process for producing water- and oil-repellent agent UNIMATEC CO., LTD (JP) 2009-11-10 US claimed
US-7214815-B2 Metallic copper catalyst for polyfluoroalkylethyl iodide production and process for producing polyfluoroalkylethyl iodide DAIKIN INDUSTRIES, LTD. (JP) 2007-05-08 US claimed
US-20050250966-A1 Metallic copper catalyst for polyfluoroalkylethyl iodide production and process for producing polyfluoroalkylethyl iodide DAIKIN INDUSTRIES, LTD. (JP) 2005-11-10 US claimed
CN-1662302-A Metallic copper catalyst for polyfluoroalkylethyl iodide production and process for producing polyfluoroalkylethyl iodide DAIKIN IND LTD (JP) 2005-08-31 CN claimed
WO-2019186987-A1 COMPOSITE PARTICLE 互応化学工業株式会社 2019-10-03 WO disclosed
WO-2019186779-A1 RESIN COMPOSITION FOR COATING 互応化学工業株式会社 2019-10-03 WO disclosed
US-9879153-B2 Anti-icing composite WANG LIANG (US) 2018-01-30 US disclosed
US-20160009971-A1 Anti-Icing Composite WANG LIANG (US) 2016-01-14 US disclosed
US-7214815-B2 Metallic copper catalyst for polyfluoroalkylethyl iodide production and process for producing polyfluoroalkylethyl iodide DAIKIN INDUSTRIES, LTD. (JP) 2007-05-08 US disclosed
US-20050250966-A1 Metallic copper catalyst for polyfluoroalkylethyl iodide production and process for producing polyfluoroalkylethyl iodide DAIKIN INDUSTRIES, LTD. (JP) 2005-11-10 US disclosed
CN-1662302-A Metallic copper catalyst for polyfluoroalkylethyl iodide production and process for producing polyfluoroalkylethyl iodide DAIKIN IND LTD (JP) 2005-08-31 CN disclosed