SCHEMBL9067645

SCHEMBL9067645

C=CCC1OCC2COC1O2

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 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
SCHEMBL2105420 0.69 TDP1 (0.38) TDP1
SCHEMBL2805805 0.67
SCHEMBL2801880 0.67
SCHEMBL1908312 0.66
SCHEMBL3716678 0.66
SCHEMBL5066855 0.64
SCHEMBL14539095 0.62 THRB (0.32) TDP1
SCHEMBL11500145 0.61 TDP1 (0.31) TDP1
SCHEMBL10419840 0.61 TDP1 (0.31) TDP1
SCHEMBL334656 0.61

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-5489580-A ANTITUMOR AGENTS AND IMMUNO MODULATORS UNIVERSITY OF CONNECTICUT (US) 1996-02-06 US disclosed