SCHEMBL28322014

SCHEMBL28322014

CCc1ccc(C(CC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)OOC(C)(C)C)cc1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 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
SCHEMBL28452010 0.86
SCHEMBL28320895 0.86
SCHEMBL28321941 0.86 AOC3 (0.34)
SCHEMBL28320891 0.85
SCHEMBL28321935 0.85
SCHEMBL28320890 0.85 SLC6A4 (0.33) TSHRMAPK1
SCHEMBL28441002 0.85 AOC3 (0.33)
SCHEMBL28441514 0.85 SLC6A4 (0.32) TSHRMAPK1
SCHEMBL28452007 0.84 AOC3 (0.35) TSHRMAPK1TDP1L3MBTL1
SCHEMBL28439723 0.83 SLC6A4 (0.32) TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110357842-B Fluoroalkyl substituted furan compound and preparation method thereof 南京工业大学 2022-12-16 CN claimed
CN-111574564-A Fluoroalkyl-substituted furyl diphosphine oxygen compound and preparation method thereof 南京工业大学 2020-08-25 CN claimed
CN-111560038-A Fluoroalkyl-substituted furyl monophosphine oxide compound and preparation method thereof 南京工业大学 2020-08-21 CN claimed
CN-110357842-A Fluoroalkyl substituted furan compound and preparation method thereof 南京工业大学 2019-10-22 CN claimed
CN-110357842-B Fluoroalkyl substituted furan compound and preparation method thereof 南京工业大学 2022-12-16 CN disclosed
CN-111574564-A Fluoroalkyl-substituted furyl diphosphine oxygen compound and preparation method thereof 南京工业大学 2020-08-25 CN disclosed
CN-111560038-A Fluoroalkyl-substituted furyl monophosphine oxide compound and preparation method thereof 南京工业大学 2020-08-21 CN disclosed
CN-110357842-A Fluoroalkyl substituted furan compound and preparation method thereof 南京工业大学 2019-10-22 CN disclosed