Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL27763567

C#CCC1CCNCC1.CC(C)(C)OC=O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
KDM1A O60341 1/20 0.32
ITGB3 P05106 1/20 0.31
ITGA2B P08514 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
Tert-Butyl Formate SCHEMBL27807762 0.84 TDP1 (0.41) TDP1KDM1A
Tert-Butyl Formate SCHEMBL27722913 0.83 TDP1 (0.50) TDP1KDM1AITGB3ITGA2B
Tert-Butyl Formate SCHEMBL28050472 0.82 TDP1 (0.45) TDP1KDM1AITGB3ITGA2B
Tert-Butyl Formate SCHEMBL27702406 0.82 TDP1 (0.48) TDP1KDM1AITGB3ITGA2B
Tert-Butyl Formate SCHEMBL27721999 0.80 TDP1 (0.46) TDP1KDM1AITGB3ITGA2B
Tert-Butyl Formate SCHEMBL27591602 0.80 TDP1 (0.46) TDP1KDM1AITGB3ITGA2B
Tert-Butyl Formate SCHEMBL28016851 0.79 TDP1 (0.45) TDP1KDM1AITGB3ITGA2B
Tert-Butyl Formate SCHEMBL27527154 0.79 TDP1 (0.45) TDP1
Tert-Butyl Formate SCHEMBL27663311 0.79 TDP1 (0.45) TDP1KDM1AITGB3ITGA2B
Tert-Butyl Formate SCHEMBL28007513 0.79 TDP1 (0.45) TDP1KDM1AITGB3ITGA2B

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106132954-B 1,3- benzodioxole derivative 第三共株式会社 2019-01-08 CN disclosed
CN-106132954-A 1,3 benzodioxole derivant 第三共株式会社 2016-11-16 CN disclosed
CN-103391936-B Carcinostatic agent THE UNIVERSITY OF TOKYO (JP) 2016-04-27 CN disclosed
CN-103391936-A Anticancer agent NAT UNIV CORP UNIV TOKYO 2013-11-13 CN disclosed
CN-101679425-B 6-(pyrrolopyridinyl)-pyrimidine-2-yl-amine and its uses in treating cancer and AIDS MERCK PATENT GMBH 2013-11-06 CN disclosed
CN-101437829-B Bisadenosine compounds as adenosine A2A receptor agonists NOVARTIS AG 2012-03-21 CN disclosed
CN-101679425-A 6-(pyrrolopyridinyl)-pyrimidine-2-yl-amine derivatives MERCK PATENT GMBH 2010-03-24 CN disclosed
CN-101522687-A Heterobicyclic thiophene compounds and methods of use ARRAY BIOPHARMA INC (US) 2009-09-02 CN disclosed
CN-101437829-A Bisadenosine compounds as adenosine A2A receptor agonists NOVARTIS AG (CH) 2009-05-20 CN disclosed