SCHEMBL598620

SCHEMBL598620

Cc1ccc(C(C)C)cc1C(C)C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.60
PTGS1 P23219 2/20 0.58
TRPA1 O75762 2/20 0.58
CACNA1C Q13936 1/20 0.58
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
FABP3 P05413 2/20 0.40
FABP4 P15090 2/20 0.40
HTT P42858 2/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
ALOX12 P18054 1/20 0.40
HIF1A Q16665 1/20 0.40
FABP5 Q01469 1/20 0.39
BCHE P06276 3/20 0.39
ACHE P22303 3/20 0.39
PTGS2 P35354 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
RNASEH1 O60930 1/20 0.38
CHRM1 P11229 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
SCHEMBL30632575 1.00 LMNA (0.60) LMNAPTGS1TRPA1CACNA1CGABRA1
SCHEMBL15927660 0.86 LMNA (0.45) LMNAPTGS1TRPA1CACNA1CGABRA1
SCHEMBL24495400 0.86 LMNA (0.45) LMNAPTGS1TRPA1CACNA1CGABRA1
SCHEMBL30398529 0.84 PTGS1 (0.57) LMNAPTGS1TRPA1CACNA1CGABRA1
SCHEMBL25549846 0.84 LMNA (0.54) LMNAPTGS1TRPA1CACNA1CGABRA1
SCHEMBL19120766 0.84 LMNA (0.54) LMNAPTGS1TRPA1CACNA1CGABRA1
SCHEMBL22356523 0.84 LMNA (0.54) LMNAPTGS1TRPA1CACNA1CGABRA1
SCHEMBL5904899 0.82 LMNA (0.52) LMNAPTGS1TRPA1CACNA1CHTT
SCHEMBL25707318 0.81 LMNA (0.50) LMNAPTGS1TRPA1CACNA1CHTT
SCHEMBL26938093 0.81 LMNA (0.41) LMNAPTGS1TRPA1CACNA1CGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111039743-B Method for isomerizing isopropyl toluene by using solid catalyst 浙江新和成股份有限公司 2022-07-05 CN claimed
CN-111039743-A Method for isomerizing isopropyl toluene by using solid catalyst 浙江新和成股份有限公司 2020-04-21 CN claimed
EP-0914310-B1 AROMATIC CONVERSION PROCESSES AND ZEOLITE CATALYST USEFUL THEREIN EXXONMOBIL CHEM PATENTS INC (US) 2003-10-01 EP claimed
US-20030119830-A1 Monocyte chemoattractant protein-1 inhibitor compounds ZENECA LIMITED 2003-06-26 US claimed
US-20020137977-A1 Aromatic conversion processes and zeolite catalyst useful therein EXXONMOBIL CHEMICAL PATENTS INC. 2002-09-26 US claimed
CN-1088049-C Aromatic conversion processes and zeolite catalyst useful therein EXXON MOBIL CHEM PATENTS INC (US) 2002-07-24 CN claimed
US-20010002426-A1 Hydrocarbon conversion process using a zeolite bound zeolite catalyst MOHR GARY DAVID (US) 2001-05-31 US claimed
CN-1059424-C Hydrocarbon conversion process using zeolite bound zeolite catalyst EXXON CHEMICAL PATENTS INC (US) 2000-12-13 CN claimed
US-6111157-A ISOMERIZATION, ALKYLATION, AND/OR TRANSALKYLATION OF AROMATIC HYDROCARBONS USING ZEOLITE BOUND ZEOLITE CATALYSTS EXXON CHEMICAL PATENTS, INC. (US) 2000-08-29 US claimed
EP-0793634-B1 HYDROCARBON CONVERSION PROCESS USING A ZEOLITE BOUND ZEOLITE CATALYST EXXON CHEMICAL PATENTS INC (US) 1999-08-18 EP claimed
EP-0018803-B1 PROCESS FOR PREPARATION OF AROMATIC TERTIARY HYDROPEROXIDES AND PHENOLS PREPARED THEREFROM MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1982-05-12 EP claimed
US-4314091-A Preparation of 1-methyl-3,5-diisopropyl benzene from charge streams containing diisopropyl toluene TEXACO INC. (US) 1982-02-02 US claimed
US-4297508-A BY REACTING CARBON DIOXIDE WITH B-NAPHTHOL, AN ALKALI METAL SALT OF B-NAPHTHOL, AND AN ALKYLBENZENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-10-27 US claimed
US-4288637-A COPPER PEROXIDATION CATALYSTS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1981-09-08 US claimed
EP-0018803-A1 Process for preparation of aromatic tertiary hydroperoxides and phenols prepared therefrom MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1980-11-12 EP claimed
US-4108907-A Process for the preparation of polyalkylbenzene hydroperoxides KOPPERS COMPANY, INC. (US) 1978-08-22 US claimed
US-3969420-A Process for recovering resorcinol and hydroquinone in mixture SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-07-13 US claimed
US-3962366-A COMPLEXING, HYDROGEN FLUORIDE, BORON TRIFLUORIDE SOCIETE CHIMIQUE DES CHARBONNAGES (FR) 1976-06-08 US claimed
US-3952037-A Aluminum catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-04-20 US claimed
US-3933921-A Process for the production of hydroperoxides SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-01-20 US claimed

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

For each of this compound's patents that has machine-readable text (2 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-20030119830-A1 Monocyte chemoattractant protein-1 inhibitor compounds CCL2, CCL11, CCR1 LMNA 3090/4885PTGS1 269/4885TRPA1 3849/4885
US-20020137977-A1 Aromatic conversion processes and zeolite catalyst useful therein AHR, PAH, ALKBH3 LMNA 688/4885PTGS1 3615/4885TRPA1 13/4885

“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.