Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL28297827

CC(C)(C)OC=O.N#CC=C1CCN1

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43

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 SCHEMBL28027171 0.79 TDP1 (0.42) TDP1
SCHEMBL19953556 0.78
SCHEMBL19953557 0.78
Tert-Butyl Formate SCHEMBL28026595 0.76 TDP1 (0.46) TDP1
Tert-Butyl Formate SCHEMBL27857624 0.68
SCHEMBL12986369 0.68
SCHEMBL12986374 0.68
Tert-Butyl Formate SCHEMBL17956883 0.67 TDP1 (0.68) TDP1
Tert-Butyl Formate SCHEMBL28092916 0.67 TDP1 (0.68) TDP1
Tert-Butyl Formate SCHEMBL28331255 0.67 TDP1 (0.68) 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-105294699-B Ba Rui replaces the preparation method of Buddhist nun 上海勋和医药科技有限公司 2019-06-11 CN disclosed