Tert-Butanol

Tert-Butanol

SCHEMBL6818802

CC(C)(C)O.CCCCOCCCC

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.62
HTT P42858 2/20 0.48
MEN1 O00255 1/20 0.48
THRB P10828 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 1/20 0.48
CYP3A4 P08684 2/20 0.46
CES1 P23141 1/20 0.45
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
CES2 O00748 2/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.39
ATM Q13315 1/20 0.37
USP2 O75604 1/20 0.37

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
SCHEMBL27855475 0.94 TSHR (0.62) TSHRHTTMEN1THRBKMT2A
Amylene Hydrate SCHEMBL28294962 0.89 TSHR (0.56) TSHRHTTMEN1THRBKMT2A
SCHEMBL28182140 0.89 TSHR (0.56) TSHRHTTMEN1THRBKMT2A
Hydrogen Peroxide SCHEMBL28446111 0.84 TSHR (0.72) TSHRHTTMEN1THRBKMT2A
Methyl Alcohol SCHEMBL2390958 0.84 TSHR (0.72) TSHRHTTMEN1THRBKMT2A
SCHEMBL28748446 0.84 TSHR (0.71) TSHRHTTMEN1THRBKMT2A
SCHEMBL8600029 0.84 TSHR (0.71) TSHRHTTMEN1THRBKMT2A
SCHEMBL439119 0.84 TSHR (0.71) TSHRHTTMEN1THRBKMT2A
SCHEMBL15167 0.84
SCHEMBL27387930 0.83 HTT (0.62) TSHRHTTMEN1THRBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105037112-A Batch extractive distillation separation method of ethyl tert-butyl ether/tert-butyl alcohol azeotropic mixture UNIV JINAN 2015-11-11 CN claimed
EP-0996430-B1 NUCLEOTIDE ANALOG COMPOSITIONS GILEAD SCIENCES INC (US) 2002-11-27 EP claimed
US-6451340-B1 CRYSTALLINE ADEFOVIR DIPIVOXIL GILEAD SCIENCES, INC. 2002-09-17 US claimed
US-20020045599-A1 Nucleotide analog compositions GILEAD SCIENCES, INC. 2002-04-18 US claimed
EP-0996430-A2 NUCLEOTIDE ANALOG COMPOSITIONS GILEAD SCIENCES, INC. (US) 2000-05-03 EP claimed
WO-1999004774-A2 NUCLEOTIDE ANALOG COMPOSITIONS GILEAD SCIENCES, INC. (US) 1999-02-04 WO claimed
CN-105037112-A Batch extractive distillation separation method of ethyl tert-butyl ether/tert-butyl alcohol azeotropic mixture UNIV JINAN 2015-11-11 CN disclosed
CN-101899062-B Synthesis technology of alpha-chiral boric acid and boric acid ester SHANGHAI VIWIT PHARMACEUTICAL CO LTD 2015-04-15 CN disclosed
CN-101899062-A Synthesis technology of alpha-chiral boric acid and boric acid ester VIWIT PHARMACEUTICAL CO LTD 2010-12-01 CN disclosed
EP-1256584-B1 Process for preparing Adefovir Dipivoxil GILEAD SCIENCES INC (US) 2004-09-29 EP disclosed
EP-0996430-B1 NUCLEOTIDE ANALOG COMPOSITIONS GILEAD SCIENCES INC (US) 2002-11-27 EP disclosed
EP-1256585-A1 Process fot preparing 9-(2-(diethylphosphonomethoxy)ethyl)-adenine GILEAD SCIENCES, INC. (US) 2002-11-13 EP disclosed
EP-1256584-A1 Process for preparing adefovir dipivoxil GILEAD SCIENCES, INC. (US) 2002-11-13 EP disclosed
US-6451340-B1 CRYSTALLINE ADEFOVIR DIPIVOXIL GILEAD SCIENCES, INC. 2002-09-17 US disclosed
US-20020045599-A1 Nucleotide analog compositions GILEAD SCIENCES, INC. 2002-04-18 US disclosed
EP-0996430-A2 NUCLEOTIDE ANALOG COMPOSITIONS GILEAD SCIENCES, INC. (US) 2000-05-03 EP disclosed
WO-1999004774-A2 NUCLEOTIDE ANALOG COMPOSITIONS GILEAD SCIENCES, INC. (US) 1999-02-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020045599-A1 Nucleotide analog compositions NUDT1, PNP, TYMP TSHR 4705/4885HTT 3208/4885MEN1 3246/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.