Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL27783166

CC(C)(C)OC=O.CC1CNCCC1O

nearest known ligand 0.43

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Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
SSTR4 P31391 8/20 0.33
SSTR1 P30872 6/20 0.33
FUCA1 P04066 2/20 0.33
SLC6A1 P30531 2/20 0.30
GABRA5 P31644 2/20 0.30
GABRB2 P47870 2/20 0.30
SLC6A12 P48065 2/20 0.30
SLC6A11 P48066 2/20 0.30
SLC6A13 Q9NSD5 2/20 0.30
GABRA1 P14867 1/20 0.30
GABRR1 P24046 1/20 0.30
GABRA4 P48169 1/20 0.30

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 SCHEMBL28106915 0.88 TDP1 (0.45) TDP1FUCA1SLC6A1GABRA5GABRB2
Tert-Butyl Formate SCHEMBL27653367 0.84 TDP1 (0.41) TDP1SSTR4SSTR1
Tert-Butyl Formate SCHEMBL28105360 0.84 TDP1 (0.41) TDP1SSTR4SSTR1
Tert-Butyl Formate SCHEMBL28785569 0.84 TDP1 (0.41) TDP1SSTR4SSTR1
Tert-Butyl Formate SCHEMBL27653754 0.83 TDP1 (0.46) TDP1SLC6A1GABRA5GABRB2SLC6A12
Tert-Butyl Formate SCHEMBL27598188 0.83 TDP1 (0.46) TDP1SLC6A1GABRA5GABRB2SLC6A12
Tert-Butyl Formate SCHEMBL20981775 0.83 TDP1 (0.46) TDP1SLC6A1GABRA5GABRB2SLC6A12
Tert-Butyl Formate SCHEMBL28026243 0.81 TDP1 (0.38) TDP1SLC6A1GABRA5GABRB2SLC6A12
Tert-Butyl Formate SCHEMBL28265972 0.81 TDP1 (0.48) TDP1SSTR4SSTR1
Tert-Butyl Formate SCHEMBL27699264 0.81 TDP1 (0.41) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104520292-B Sulphonylpiperidine derivant and they are for treating the purposes of disease of front dynein mediation 武田药品工业株式会社 2016-09-14 CN disclosed
CN-104520292-A Sulfonyl piperidine derivatives and use for treating prokineticin mediated diseases TAKEDA PHARMACEUTICAL 2015-04-15 CN disclosed
CN-101754962-B N-azacyclic substituted pyrrole, imidazole, triazole and tetrazole derivatives as agonists of RUP3 or GPR119 for treatment of diabetes and metabolic disorders METABOLEX INC 2013-12-25 CN disclosed
CN-101754962-A N-azacyclic substituted pyrrole, imidazole, triazole and tetrazole derivatives as agonists of the RUP3 or GPR119 for the treatment of diabetes and metabolic disorders METABOLEX INC 2010-06-23 CN disclosed