SCHEMBL4282143

SCHEMBL4282143

C=CCOOC(CC(=O)O)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CASP1 P29466 2/20 0.31
SLC22A6 Q4U2R8 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
SCHEMBL3259337 0.82 CPA1 (0.39)
SCHEMBL3262845 0.81 SMN1; SMN2 (0.34) TDP1SMN1; SMN2
SCHEMBL7708142 0.80 TDP1 (0.36) TDP1SMN1; SMN2CASP1SLC22A6
SCHEMBL11689315 0.77 TDP1 (0.40) TDP1SMN1; SMN2SLC22A6
SCHEMBL5157972 0.76 TDP1 (0.48) TDP1SMN1; SMN2SLC22A6
SCHEMBL28662464 0.75 TSHR (0.40)
SCHEMBL28631010 0.73 TSHR (0.45)
SCHEMBL3263008 0.70
SCHEMBL8927018 0.69 CA1 (0.46) SMN1; SMN2SLC22A6
SCHEMBL515962 0.69 TDP1 (0.33) TDP1SMN1; SMN2SLC22A6

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
US-20090022645-A1 BLEACHING ACTIVATOR AND DETERGENT COMPOSITION COMPRISING THE SAME NIPPON SHOKUBAI CO., LTD. (JP) 2009-01-22 US disclosed
US-5942152-A A CATALYST IN BLEACH SYSTEMS FOR BLEACHING TEXTILE MATERIAL AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) 1999-08-24 US disclosed
US-5928382-A COMPRISING BLEACHING AGENT ABD POLYOXOMETALLATE; TEXTILES, SOLID SURFACES CLARIANT GMBH (DE) 1999-07-27 US disclosed