Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL28044015

CC(C)(C)OC=O.CC1CC(=O)CCN1C

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL20436910 0.81
SCHEMBL167424 0.81
Formamide SCHEMBL26614879 0.80
Tert-Butyl Formate SCHEMBL28094958 0.77 MAPK1 (0.35) TDP1
Tert-Butyl Formate SCHEMBL28750430 0.76 TDP1 (0.50) TDP1
Tert-Butyl Formate SCHEMBL28284769 0.71 TDP1 (0.48) TDP1
Tert-Butyl Formate SCHEMBL28255359 0.71 TDP1 (0.48) TDP1
Tert-Butyl Formate SCHEMBL28275054 0.71 TDP1 (0.48) TDP1
Tert-Butyl Formate SCHEMBL28052001 0.71 TDP1 (0.43) TDP1
Tert-Butyl Formate SCHEMBL27651272 0.71 TDP1 (0.43) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110041250-A The benzene compound being substituted EPIZYME股份有限公司 2019-07-23 CN disclosed
CN-105102432-B Substituted Benzene Compounds EPIZYME股份有限公司 2019-01-04 CN disclosed
CN-105102432-A Substituted benzene compounds EPIZYME INC 2015-11-25 CN disclosed