SCHEMBL4747186

SCHEMBL4747186

C=C(C)C(=O)OCCNS(=O)(=O)C(C)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.35
THRB P10828 1/20 0.33

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
SCHEMBL3968321 0.83 TSHR (0.35) TSHRTHRB
SCHEMBL10212543 0.78 CA1 (0.46) TSHRTHRB
SCHEMBL2632780 0.77 CA1 (0.40) TSHRTHRB
SCHEMBL3841895 0.77 THRB (0.34) TSHRTHRB
SCHEMBL14769572 0.76 THRB (0.42) TSHRTHRB
SCHEMBL15836509 0.73 THRB (0.40) TSHRTHRB
SCHEMBL217339 0.73 THRB (0.42) TSHRTHRB
SCHEMBL28688493 0.72 TSHR (0.51) TSHRTHRB
SCHEMBL10903283 0.72 GBA1 (0.34) TSHRTHRB
SCHEMBL10902196 0.72 GBA1 (0.34) TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008115457-A2 FLUOROBETAINE COPOLYMER AND FIRE FIGHTING FOAM CONCENTRATES THEREFROM E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-09-25 WO disclosed