SCHEMBL7071675

SCHEMBL7071675

O=C(O)OCC(OC(=O)O)C(OC(=O)O)C(OC(=O)O)C(COC(=O)O)OC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL295583 0.87 TDP1 (0.37) TDP1
SCHEMBL1730349 0.87 TDP1 (0.37) TDP1
SCHEMBL6814125 0.86 TDP1 (0.40) TDP1
SCHEMBL14796600 0.86 TDP1 (0.40) TDP1
SCHEMBL17727607 0.81 PDE4A (0.37) TDP1
SCHEMBL8516629 0.81 TDP1 (0.33) TDP1
SCHEMBL20423633 0.79 TDP1 (0.36) TDP1
SCHEMBL376766 0.79 TDP1 (0.32) TDP1
SCHEMBL8078509 0.79 TDP1 (0.36) TDP1
SCHEMBL9671288 0.77 TDP1 (0.35) TDP1

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
EP-0799887-B1 Fabric softener compositions PROCTER & GAMBLE (US) 2003-06-11 EP claimed