SCHEMBL5676703

SCHEMBL5676703

C=C(C)C(N)=O.NC(=O)/C=C\C(N)=O

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.71
ALDH1A1 P00352 3/20 0.40
TSHR P16473 1/20 0.40
FGFR4 P22455 1/20 0.40
LMNA P02545 1/20 0.39
ALOX15 P16050 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
DDAH1 O94760 1/20 0.33
LDHA P00338 1/20 0.30
LDHB P07195 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
SCHEMBL28137078 0.87 TDP1 (0.60) TDP1ALDH1A1TSHRFGFR4LMNA
SCHEMBL14870 0.84
SCHEMBL5708652 0.84 TDP1 (1.00) TDP1ALDH1A1TSHRFGFR4LMNA
SCHEMBL2128293 0.84 TDP1 (1.00) TDP1ALDH1A1TSHRFGFR4LMNA
SCHEMBL4558369 0.83 TDP1 (0.48) TDP1ALDH1A1TSHRFGFR4LMNA
Acrylamide SCHEMBL5199486 0.82 TDP1 (0.71) TDP1ALDH1A1TSHRFGFR4LMNA
Acrylamide SCHEMBL460343 0.82 TDP1 (0.71) TDP1ALDH1A1TSHRFGFR4LMNA
SCHEMBL10504642 0.82
Acrylamide SCHEMBL28724334 0.82 TDP1 (0.71) TDP1ALDH1A1TSHRFGFR4LMNA
SCHEMBL10504656 0.82

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-1109869-B8 AQUEOUS POWDER LACQUER DISPERSION BASF COATINGS AG (DE) 2006-01-18 EP disclosed
EP-1109869-A1 AQUEOUS POWDER LACQUER DISPERSION BASF Coatings AG (DE) 2001-06-27 EP disclosed
WO-2000008107-A1 AQUEOUS POWDER LACQUER DISPERSION BASF COATINGS AG (DE) 2000-02-17 WO disclosed