SCHEMBL17613641

SCHEMBL17613641

CC(C)C(=O)SCCSCCO

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
ROCK2 O75116 1/20 0.37
BHMT Q93088 1/20 0.31

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
SCHEMBL13425137 0.86
SCHEMBL6624332 0.76 SMN1; SMN2 (0.39)
SCHEMBL13853422 0.72
SCHEMBL17613656 0.71 TDP1 (0.46) TDP1ROCK2
SCHEMBL12023026 0.71 TSHR (0.40)
SCHEMBL6548989 0.70
Thiodiglycol SCHEMBL27559563 0.70 TP53 (0.55) TDP1ROCK2BHMT
SCHEMBL17613605 0.70 TDP1 (0.43) TDP1
SCHEMBL195715 0.69 TDP1 (0.91) TDP1ROCK2
SCHEMBL9638413 0.69 TDP1 (0.91) TDP1ROCK2

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-2346883-B1 SELF DELIVERING BIO-LABILE PHOSPHATE PROTECTED PRO-OLIGOS FOR OLIGONUCLEOTIDE BASED THERAPEUTICS AND MEDIATING RNA INTERFERENCE PETERSEN SCOTT G (US) 2016-03-23 EP disclosed