SCHEMBL5162996

SCHEMBL5162996

CCC(=C(C)C(=O)O)N(S(C)(=O)=O)S(C)(=O)=O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
THRB P10828 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
PGGT1B P53609 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
SCHEMBL5162989 1.00 FFAR3 (0.31) FFAR3ALDH1A1TDP1THRBFNTA
SCHEMBL7100700 0.84 FNTA (0.36) FFAR3THRBFNTAFNTBPGGT1B
Sulfuric Acid SCHEMBL2953822 0.75 FFAR3 (0.31) FFAR3ALDH1A1TDP1THRBFNTA
SCHEMBL44909 0.73 ALDH1A1 (0.36) FFAR3ALDH1A1TDP1THRBFNTA
SCHEMBL109778 0.73 ALDH1A1 (0.36) FFAR3ALDH1A1TDP1THRBFNTA
SCHEMBL20377697 0.72 FFAR3 (0.32) FFAR3ALDH1A1TDP1THRBFNTA
SCHEMBL3279128 0.72 FFAR3 (0.32) FFAR3ALDH1A1TDP1THRBFNTA
Sulfuric Acid SCHEMBL8142557 0.72 THRB (0.32) THRBFNTAFNTBPGGT1B
Acetic Acid SCHEMBL6238297 0.71 FFAR3 (0.35) FFAR3ALDH1A1TDP1THRBFNTA
SCHEMBL119068 0.71 LMNA (0.36) FFAR3ALDH1A1TDP1THRBFNTA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1373980-A4 HIGH PERFORMANCE, PHOTOIMAGEABLE RESIN COMPOSITIONS AND PRINTING PLATES PREPARED THEREFROM NAPP SYSTEMS INC (US) 2007-12-05 EP claimed
EP-1373980-A1 HIGH PERFORMANCE, PHOTOIMAGEABLE RESIN COMPOSITIONS AND PRINTING PLATES PREPARED THEREFROM Napp Systems, Inc. (US) 2004-01-02 EP claimed
WO-2002079879-A1 HIGH PERFORMANCE, PHOTOIMAGEABLE RESIN COMPOSITIONS AND PRINTING PLATES PREPARED THEREFROM NAPP SYSTEMS, INC. (US) 2002-10-10 WO claimed