SCHEMBL28830951

SCHEMBL28830951

CC(O)N(C(C)O)C(C)(C)OC=O

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.40

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
Tert-Butyl Formate SCHEMBL2252376 0.70 TDP1 (0.72) TDP1
Ammonia Solution, Strong SCHEMBL3682014 0.67 TDP1 (0.43) TDP1
SCHEMBL29165046 0.65 TDP1 (0.41) TDP1
SCHEMBL17532663 0.65 TDP1 (0.42) TDP1
SCHEMBL10249329 0.64
SCHEMBL115483 0.63 ALDH1A1 (0.33)
SCHEMBL7064853 0.62 TDP1 (0.39) TDP1
SCHEMBL300633 0.61 ALDH1A1 (0.32)
SCHEMBL12350125 0.61
Tert-Butyl Formate SCHEMBL28884215 0.60 TDP1 (0.72) 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
CN-105754556-A Composite phase change energy storage material containing ionic liquid and preparation method thereof 马鞍山市博浪热能科技有限公司 2016-07-13 CN disclosed