Tert-Butanol

Tert-Butanol

SCHEMBL28036841

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

nearest known ligand 0.48

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.48
MGAM O43451 2/20 0.43
GAA P10253 2/20 0.43
SI P14410 2/20 0.43
MGAM2 Q2M2H8 2/20 0.43
HSD17B10 Q99714 2/20 0.43
TET2 Q6N021 1/20 0.41
RECQL P46063 2/20 0.39
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CA12 O43570 2/20 0.34
CA14 Q9ULX7 2/20 0.34
NAAA Q02083 1/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
CA2 P00918 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
FFAR3 O14843 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL27583315 0.88 TSHR (0.59) TSHRMGAMGAASIMGAM2
SCHEMBL3288569 0.88
SCHEMBL15434 0.88
Chloromethane SCHEMBL11868053 0.86 TSHR (0.50) TSHRMGAMGAASIMGAM2
SCHEMBL4652748 0.85
Ammonia Solution, Strong SCHEMBL116114 0.85
Methyl Alcohol SCHEMBL818529 0.85
SCHEMBL6445886 0.85 TSHR (0.56) TSHRMGAMGAASIMGAM2
SCHEMBL11169080 0.85
Methoxymethane SCHEMBL7245196 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105152926-A Distillation separation method for azeotrope of tert-butanol and methylpropionate by using mixed solvent as extractant UNIV JINAN 2015-12-16 CN claimed
CN-105037155-A Batch distillation process for separating tert-butyl alcohol-methyl propionate azeotrope by mixed extractant UNIV JINAN 2015-11-11 CN claimed
CN-105152856-A Batch distillation process for separating isopropanol-propylmethanoate azeotrope by using mixed extractant UNIV JINAN 2015-12-16 CN disclosed
CN-105152926-A Distillation separation method for azeotrope of tert-butanol and methylpropionate by using mixed solvent as extractant UNIV JINAN 2015-12-16 CN disclosed
CN-105037155-A Batch distillation process for separating tert-butyl alcohol-methyl propionate azeotrope by mixed extractant UNIV JINAN 2015-11-11 CN disclosed
CN-105037155-A Batch distillation process for separating tert-butyl alcohol-methyl propionate azeotrope by mixed extractant UNIV JINAN 2015-11-11 CN disclosed
CN-105037155-A Batch distillation process for separating tert-butyl alcohol-methyl propionate azeotrope by mixed extractant UNIV JINAN 2015-11-11 CN disclosed