SCHEMBL6284868

SCHEMBL6284868

Cc1ccc(OO)c(C(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
TRPA1 O75762 1/20 0.50
CHRM1 P11229 1/20 0.50
SLC6A2 P23975 1/20 0.50
ADRA1A P35348 1/20 0.50
HTR2B P41595 1/20 0.50
ACHE P22303 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
LPAR1 Q92633 1/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL11211488 0.87 TRPA1 (0.40) LMNATRPA1CHRM1SLC6A2ADRA1A
SCHEMBL11010571 0.83 LMNA (0.48) LMNATRPA1CHRM1SLC6A2ADRA1A
SCHEMBL29591727 0.81 ACHE (0.58) LMNATRPA1CHRM1SLC6A2ADRA1A
SCHEMBL10238859 0.81 ACHE (0.58) LMNATRPA1CHRM1SLC6A2ADRA1A
SCHEMBL3191477 0.79 GABRA1 (0.41) LMNATRPA1ACHEKDM4EALDH1A1
SCHEMBL9945998 0.79 LMNA (0.45) LMNATRPA1CHRM1SLC6A2ADRA1A
SCHEMBL13640205 0.79 ADRA1A (0.48) LMNATRPA1CHRM1SLC6A2ADRA1A
SCHEMBL465786 0.78 HTR2A (0.47) LMNATRPA1CHRM1SLC6A2ADRA1A
SCHEMBL9945918 0.78 L3MBTL1 (0.46) LMNATRPA1CHRM1SLC6A2ADRA1A
Hydrochloric Acid SCHEMBL27516547 0.78 LMNA (0.44) LMNATRPA1CHRM1SLC6A2ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0028910-B1 IMPROVED PROCESS FOR PRODUCING PHENOLIC COMPOUNDS FROM ARALKYL HYDROPEROXIDES MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1983-04-20 EP claimed
US-4328377-A ACID CLEAVAGE OF ARYL HYDROPEROXIDES MITSUI PETROCHEMICAL INDUSTRIES LTD. (JP) 1982-05-04 US claimed
EP-0028910-A1 Improved process for producing phenolic compounds from aralkyl hydroperoxides MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1981-05-20 EP claimed
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
EP-1175384-B1 REMOVAL OF SALTS IN THE MANUFACTURE OF PHENOLIC COMPOUND SHELL INT RESEARCH (NL) 2003-09-10 EP disclosed
EP-1175384-A1 REMOVAL OF SALTS IN THE MANUFACTURE OF PHENOLIC COMPOUND SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 2002-01-30 EP disclosed
US-20010000260-A1 Removal of salts in the manufacture of phenolic compound SHELL OIL COMPANY 2001-04-12 US disclosed
WO-2000066523-A1 REMOVAL OF SALTS IN THE MANUFACTURE OF PHENOLIC COMPOUND SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2000-11-09 WO disclosed
EP-0012613-B1 A PROCESS FOR PRODUCING 3-ALKYLPHENOLS AND 1,3-DIHYDROXYBENZENE MOBIL OIL CORPORATION (US) 1984-08-08 EP disclosed
US-4461727-A PENICILLINS BRISTOL-MYERS COMPANY (US) 1984-07-24 US disclosed
US-4328377-A ACID CLEAVAGE OF ARYL HYDROPEROXIDES MITSUI PETROCHEMICAL INDUSTRIES LTD. (JP) 1982-05-04 US disclosed
US-4282150-A CHEMICAL INTERMEDIATES FOR PENICILLINS AND CEPHALOSPORINS BRISTOL-MYERS COMPANY (US) 1981-08-04 US disclosed
US-4272437-A PENICILLINS BRISTOL-MYERS COMPANY (US) 1981-06-09 US disclosed
EP-0028910-A1 Improved process for producing phenolic compounds from aralkyl hydroperoxides MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1981-05-20 EP disclosed
EP-0028522-A1 Process for producing phenolic compounds MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1981-05-13 EP disclosed
EP-0021848-A1 Process and apparatus for the preparation of phenols MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1981-01-07 EP disclosed
US-4230894-A ISOMER SEPARATION BY CATALYTIC CRACKING USING A SELECTIVE ZEOLITE MOBIL OIL CORPORATION (US) 1980-10-28 US disclosed
US-4205189-A Method for producing 3-alkylphenols and 1,3-dihydroxybenzene MOBIL OIL CORPORATION (US) 1980-05-27 US disclosed
US-4197413-A ALKYLATION OVER SELECTIVE ZEOLITE, OXIDATION TO HYDROPEROXIDE, REARRANGEMENT MOBIL OIL CORPORATION (US) 1980-04-08 US 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-20010000260-A1 Removal of salts in the manufacture of phenolic compound SRMS, AGT, TYR LMNA 2622/4885TRPA1 3643/4885CHRM1 1907/4885

“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.