SCHEMBL20117658

SCHEMBL20117658

CCC(O)CC(C)OCC(O)CC(C)C

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.34
TSHR P16473 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
SCHEMBL10015463 0.89 TDP1 (0.38) TDP1TSHR
SCHEMBL28157696 0.87 TDP1 (0.34) TDP1
SCHEMBL10015473 0.82 TDP1 (0.33) TDP1TSHR
SCHEMBL10015474 0.82 TDP1 (0.33) TDP1
SCHEMBL9413357 0.80 TDP1 (0.35) TDP1
SCHEMBL10195414 0.79
SCHEMBL11890327 0.79
SCHEMBL106791 0.79
SCHEMBL3791829 0.78 TSHR (0.35) TDP1TSHR
SCHEMBL22025331 0.77 TDP1 (0.31) 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
WO-2018078543-A1 AMPHIPHILIC BRANCHED POLYDIORGANOSILOXANE MACROMERS NOVARTIS AG (CH) 2018-05-03 WO disclosed