SCHEMBL4873895

SCHEMBL4873895

C=C(C)C(=O)NC.CCCO[PH](=O)O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
EPHX1 P07099 1/20 0.30
THRB P10828 1/20 0.30

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
Phosphonic Acid SCHEMBL375803 0.77 ALDH1A1 (0.36)
SCHEMBL282710 0.77
SCHEMBL28871197 0.75 THRB (0.32) THRB
Ammonia Solution, Strong SCHEMBL1777240 0.74
SCHEMBL28486540 0.74 TSHR (0.31) TSHR
SCHEMBL27808846 0.74
SCHEMBL28990424 0.74
Butane SCHEMBL4247130 0.74 TSHR (0.31) TSHR
SCHEMBL27343444 0.74 TSHR (0.31) TSHR
SCHEMBL28509952 0.73 TSHR (0.43) TSHREPHX1THRB

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
US-20080114128-A1 Synthesis of Copolymers in the Form of a Mikto Star by Controlled Radical Polymerization RHODIA CHIMIE (FR) 2008-05-15 US claimed