SCHEMBL28041101

SCHEMBL28041101

C=C(C)C(=O)C(C)(CN)CO

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35
KDM4E B2RXH2 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
SCHEMBL27552899 0.79 KDM4E (0.47) TDP1KDM4E
SCHEMBL19860157 0.77
SCHEMBL22189197 0.76 TDP1 (0.30) TDP1
SCHEMBL27935190 0.75 TDP1 (0.39) TDP1KDM4E
SCHEMBL28180624 0.72
SCHEMBL13829369 0.72
SCHEMBL20497400 0.71 GRM4 (0.39) TDP1
SCHEMBL2184778 0.70 TDP1 (0.39) TDP1KDM4E
SCHEMBL5597629 0.70 TDP1 (0.39) TDP1KDM4E
SCHEMBL17239823 0.70 TDP1 (0.39) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103554806-B A kind of fluorescence hyperbranched polymer-nanoclay film composite material and preparation method thereof HEFEI UNIVERSITY OF TECHNOLOGY (CN) 2016-01-06 CN claimed
CN-103554806-B A kind of fluorescence hyperbranched polymer-nanoclay film composite material and preparation method thereof HEFEI UNIVERSITY OF TECHNOLOGY (CN) 2016-01-06 CN disclosed