SCHEMBL12762147

SCHEMBL12762147

CCC(=O)C[S+](CCCC[S+](CC(=O)CC)CC(=O)CC)CC(=O)CC

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.45
FFAR3 O14843 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL685330 0.85 TDP1 (0.41) TDP1ALDH1A1
SCHEMBL6723740 0.78 TDP1 (0.50) TDP1FFAR3ALDH1A1
SCHEMBL6728345 0.69
SCHEMBL6728106 0.69 CES1 (0.44) TDP1ALDH1A1
SCHEMBL6723160 0.69 CES2 (0.42) TDP1FFAR3ALDH1A1
SCHEMBL2357325 0.65 TDP1 (1.00) TDP1FFAR3ALDH1A1
SCHEMBL42679 0.65
SCHEMBL1887087 0.65
SCHEMBL9635543 0.65 AKR1B1 (0.48) TDP1ALDH1A1
SCHEMBL17038982 0.65 TDP1 (0.41) 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
US-7914965-B2 Resist composition and method of pattern formation with the same FUJIFILM CORPORATION (JP) 2011-03-29 US disclosed