Tert-Amylbenzene

Tert-Amylbenzene

SCHEMBL2354686

CCC(C)(C)c1ccccc1.OO

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.58
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
MAPK1 P28482 2/20 0.47
LMNA P02545 1/20 0.47
CASP3 P42574 1/20 0.47
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
CYP2C19 P33261 1/20 0.46
HIF1A Q16665 1/20 0.46
ALDH1A1 P00352 2/20 0.46
ALOX15 P16050 1/20 0.46
MAPT P10636 2/20 0.45
POLB P06746 1/20 0.45
CYP2C9 P11712 1/20 0.45
ESR1 P03372 2/20 0.44
ESR2 Q92731 2/20 0.44

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-Amylbenzene SCHEMBL11362979 0.97 TAAR1 (0.56) TAAR1NPC1RAB9AMAPK1LMNA
Tert-Amylbenzene SCHEMBL131593 0.97 TAAR1 (0.61) TAAR1NPC1RAB9AMAPK1LMNA
Tert-Amylbenzene SCHEMBL27610213 0.97 TAAR1 (0.61) TAAR1NPC1RAB9AMAPK1LMNA
Tert-Amylbenzene SCHEMBL3087426 0.97 TAAR1 (0.61) TAAR1NPC1RAB9AMAPK1LMNA
Tert-Amylbenzene SCHEMBL401786 0.97 TAAR1 (0.61) TAAR1NPC1RAB9AMAPK1LMNA
Tert-Amylbenzene SCHEMBL27610212 0.97 TAAR1 (0.61) TAAR1NPC1RAB9AMAPK1LMNA
Tert-Amylbenzene SCHEMBL28241821 0.95 TAAR1 (0.58) TAAR1NPC1RAB9AMAPK1LMNA
Tert-Amylbenzene SCHEMBL27418132 0.95 TAAR1 (0.58) TAAR1NPC1RAB9AMAPK1LMNA
Tert-Amylbenzene SCHEMBL27540230 0.95 TAAR1 (0.58) TAAR1NPC1RAB9AMAPK1LMNA
Tert-Amylbenzene SCHEMBL27635269 0.92 TAAR1 (0.56) TAAR1NPC1RAB9AMAPK1LMNA

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2352715-A1 PROCESS FOR PRODUCING PHENOL Exxonmobil Chemical Company (US) 2011-08-10 EP claimed
US-20110190546-A1 Process For Producing Phenol EXXONMOBIL CHEMICAL PATENTS INC. 2011-08-04 US claimed
WO-2010042261-A1 PROCESS FOR PRODUCING PHENOL EXXONMOBIL CHEMICAL COMPANY (US) 2010-04-15 WO claimed
US-20160251289-A1 USE OF ALKANE SULFONIC ACID FOR PREPARING PHENOLIC ALCOHOL ARKEMA FRANCE (FR) 2016-09-01 US disclosed
US-9249078-B2 Mixed metal oxide catalysts and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2016-02-02 US disclosed
US-9238605-B2 Oxidation of hydrocarbons EXXONMOBIL CHEMICAL PATENTS INC. (US) 2016-01-19 US disclosed
US-20150225326-A1 Oxidation of Hydrocarbons EXXONMOBIL CHEMICAL PATENTS INC. (US) 2015-08-13 US disclosed
US-20150148567-A1 MIXED METAL OXIDE CATALYSTS AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2015-05-28 US disclosed
WO-2014039653-A2 OXIDATION OF HYDROCARBONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2014-03-13 WO disclosed
US-8445730-B2 Process for producing phenol EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-05-21 US disclosed
WO-2013052217-A2 MIXED METAL OXIDE CATALYSTS AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-04-11 WO disclosed
US-20110190546-A1 Process For Producing Phenol EXXONMOBIL CHEMICAL PATENTS INC. 2011-08-04 US disclosed
WO-2010042261-A1 PROCESS FOR PRODUCING PHENOL EXXONMOBIL CHEMICAL COMPANY (US) 2010-04-15 WO disclosed
US-6965056-B1 Removal of salts in the manufacture of phenolic compound SHELL OIL COMPANY (US) 2005-11-15 US disclosed
US-6720461-B2 ADDING WATER AND A DILUENT TO FORM A SEPARABLE CRUDE PHENOLIC BOTTOMS STREAM HAVING A COMBINED DENSITY LOWER THAN THE DENSITY OF THE BOTTOMS; SEPARATING OUT A HYDROCARBON PHASE AND A SALT-CONTAINING AQUEOUS PHASE; PHENOLS FROM PEROXIDES SHELL OIL COMPANY 2004-04-13 US disclosed
US-20010000260-A1 Removal of salts in the manufacture of phenolic compound SHELL OIL COMPANY 2001-04-12 US disclosed
US-4450303-A IN PRESENCE OF OXYGEN AND SAMARIN SALT PHILLIPS PETROLEUM COMPANY (US) 1984-05-22 US disclosed
EP-0028910-B1 IMPROVED PROCESS FOR PRODUCING PHENOLIC COMPOUNDS FROM ARALKYL HYDROPEROXIDES MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1983-04-20 EP disclosed
US-4328377-A ACID CLEAVAGE OF ARYL HYDROPEROXIDES MITSUI PETROCHEMICAL INDUSTRIES LTD. (JP) 1982-05-04 US disclosed
EP-0028910-A1 Improved process for producing phenolic compounds from aralkyl hydroperoxides MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1981-05-20 EP 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 (5 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-20160251289-A1 USE OF ALKANE SULFONIC ACID FOR PREPARING PHENOLIC ALCOHOL ADH1C, ADH1A, ADH5 TAAR1 398/4885NPC1 3529/4885RAB9A 3801/4885
US-20150148567-A1 MIXED METAL OXIDE CATALYSTS AND USE THEREOF SOD1, SOD3, LPO TAAR1 1789/4885NPC1 4245/4885RAB9A 3724/4885
US-20010000260-A1 Removal of salts in the manufacture of phenolic compound SRMS, AGT, TYR TAAR1 1107/4885NPC1 4841/4885RAB9A 3379/4885
US-20150225326-A1 Oxidation of Hydrocarbons HAO2, HMOX2, HMOX1 TAAR1 517/4885NPC1 2343/4885RAB9A 4833/4885
US-20110190546-A1 Process For Producing Phenol CYP1A1, PAH, MYB TAAR1 517/4885NPC1 4220/4885RAB9A 3493/4885

“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.