SCHEMBL3880967

SCHEMBL3880967

CCC(C)C(O)=C(C)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.34
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
PGGT1B P53609 1/20 0.34
FOLH1 Q04609 2/20 0.31
NAALAD2 Q9Y3Q0 2/20 0.31
GABRR1 P24046 2/20 0.31
CYP1A2 P05177 1/20 0.31
ALDH1A1 P00352 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
FFAR3 O14843 1/20 0.30
TSHR P16473 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
SCHEMBL21162432 0.83 FOLH1 (0.30) FOLH1NAALAD2GABRR1CYP1A2ALDH1A1
SCHEMBL6767073 0.80 THRB (0.34) THRBFNTAFNTBPGGT1BFOLH1
SCHEMBL6767072 0.80 THRB (0.34) THRBFNTAFNTBPGGT1BFOLH1
SCHEMBL28938972 0.80 THRB (0.34) THRBFNTAFNTBPGGT1BFOLH1
SCHEMBL24701088 0.79 CA2 (0.34) TDP1TSHR
SCHEMBL6760194 0.76 FFAR3 (0.33) THRBFNTAFNTBPGGT1BALDH1A1
SCHEMBL6761901 0.76 FFAR3 (0.33) THRBFNTAFNTBPGGT1BALDH1A1
SCHEMBL22090712 0.74
SCHEMBL8070690 0.73 THRB (0.33) THRBFNTAFNTBPGGT1B
SCHEMBL1072006 0.73 FFAR3 (0.35) THRBFNTAFNTBPGGT1BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1571165-B1 Compositions for the preparation of hydrophobic coatings TOFFANO LORENZO (IT) 2009-01-07 EP disclosed
EP-1571165-A1 Compositions for the preparation of hydrophobic coatings Toffano, Lorenzo (IT) 2005-09-07 EP disclosed