Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL27768122

CC(C)(C)OC=O.c1ccc(OCc2csc(C3CCNCC3)n2)cc1

nearest known ligand 0.43

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.43
HTT P42858 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 2/20 0.42
KMT2A Q03164 2/20 0.42
SLC6A3 Q01959 2/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
HPGDS O60760 1/20 0.42
MAPT P10636 2/20 0.42
AOC3 Q16853 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
EPHA2 P29317 1/20 0.40
KDR P35968 1/20 0.40
EPHB4 P54760 1/20 0.40
PRMT5 O14744 2/20 0.39
MAPK1 P28482 2/20 0.38
GAA P10253 1/20 0.38

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 SCHEMBL27768033 0.94 GPR119 (0.43) GPR119HTTNPC1RAB9AMEN1
Tert-Butyl Formate SCHEMBL28781308 0.90 GPR119 (0.44) GPR119HTTNPC1RAB9AMEN1
Tert-Butyl Formate SCHEMBL27768398 0.88 GPR119 (0.44) GPR119AOC3EPHA2KDREPHB4
Tert-Butyl Formate SCHEMBL28784622 0.86 GPR119 (0.41) GPR119HTTNPC1RAB9AMEN1
Tert-Butyl Formate SCHEMBL27973831 0.86 GPR119 (0.45) GPR119HTTNPC1RAB9AMEN1
Tert-Butyl Formate SCHEMBL27768095 0.84 GPR119 (0.46) GPR119NPC1RAB9ALMNAMAPT
Tert-Butyl Formate SCHEMBL27973923 0.84 GPR119 (0.41) GPR119HTTNPC1RAB9AMEN1
Tert-Butyl Formate SCHEMBL27789571 0.84 GPR119 (0.47) GPR119HTTNPC1RAB9AMEN1
Tert-Butyl Formate SCHEMBL27768039 0.83 GPR119 (0.52) GPR119RAB9AMEN1KMT2AAOC3
Tert-Butyl Formate SCHEMBL27768213 0.83 AOC3 (0.46) GPR119NPC1RAB9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101616586-B Heterocyclic receptor agonists for the treatment of diabetes and metabolic disorders CYMABAY THERAPEUTICS INC 2014-08-13 CN claimed
CN-101616586-B Heterocyclic receptor agonists for the treatment of diabetes and metabolic disorders CYMABAY THERAPEUTICS INC 2014-08-13 CN disclosed
CN-102026636-B Oxymethylene aryl compounds and uses thereof METABOLEX INC 2014-07-16 CN disclosed
CN-102026636-A Oxymethylene aryl compounds and uses thereof METABOLEX INC 2011-04-20 CN disclosed
CN-101616586-A The heterocyclic receptor agonists of treatment diabetes and metabolic disorder METABOLEX INC 2009-12-30 CN disclosed