Barium

Barium

SCHEMBL2729092

CC(C)(C)CC(C)(C)Sc1ccccc1.[Ba]

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MGLL Q99685 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
PRMT1 Q99873 1/20 0.34
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
RIPK1 Q13546 2/20 0.31
TAAR1 Q96RJ0 2/20 0.31
SLC6A2 P23975 1/20 0.31
FFAR1 O14842 1/20 0.30
PTPN1 P18031 1/20 0.30
PTPRZ1 P23471 1/20 0.30

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
SCHEMBL10351871 0.98 ALDH1A1 (0.37) ALDH1A1MAPK1POLBMAPTHPGD
SCHEMBL14430941 0.77 ALDH1A1 (0.39) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL199652 0.77 SHBG (0.50) ALDH1A1MAPTHPGDHSD17B10CYP3A4
SCHEMBL199651 0.77 SLC6A4 (0.32)
SCHEMBL10352481 0.77 SLC6A4 (0.36) ALDH1A1POLBMAPTCYP1A2CYP3A4
SCHEMBL2950715 0.76 ALDH1A1 (0.37) ALDH1A1MAPK1POLBMAPTHPGD
SCHEMBL776173 0.76 ALDH1A1 (0.37) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL3935115 0.76 ALDH1A1 (0.37) ALDH1A1MAPK1POLBMAPTHPGD
SCHEMBL2945120 0.76 CYP1A2 (0.53) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL1454164 0.74 ALDH1A1 (0.36) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3443055-B1 REMOVING AROMATIC COMPOUNDS FROM A HYDROCARBON FLUID CASTROL LTD (GB) 2024-07-03 EP disclosed
EP-3253852-B1 USE OF A HYDROCARBYL-SUBSTITUTED SALICYLIC ACID DETERGENT AS AN INHIBITOR OF LEAD CORROSION CASTROL LTD (GB) 2024-06-19 EP disclosed
EP-3697750-B1 SELECTIVE ACETALIZATION / ETHERIFICATION PROCESS BP PLC (GB) 2024-02-14 EP disclosed
EP-3583195-B1 ETHERIFICATION PROCESS, PROCESS FOR PREPARING A LUBRICANT COMPOSITION AND PROCESS FOR LUBRICATING A SURFACE BP PLC (GB) 2023-12-20 EP disclosed
EP-3883913-B1 PROCESS FOR MAKING ETHERS VIA ENOL ETHERS BP PLC (GB) 2023-11-01 EP disclosed
CN-113272269-B Process for preparing ethers via enol ethers 英国石油有限公司 2023-10-20 CN disclosed
US-11787760-B2 Process for making ethers via enol ethers BP P.L.C. (GB) 2023-10-17 US disclosed
EP-3746529-B1 LUBRICANT COMPOSITION CASTROL LTD (GB) 2023-07-12 EP disclosed
CN-111511710-B Selective acetalization/etherification process 英国石油有限公司 2023-05-16 CN disclosed
CN-115992021-A Use of boron-containing additives as lead corrosion inhibitors 卡斯特罗尔有限公司 2023-04-21 CN disclosed
EP-0294096-A1 Improved process for preparing stable oleaginous compositions EXXON CHEMICAL PATENTS INC. (US) 1988-12-07 EP disclosed
EP-0288324-A2 Novel dispersants for oleaginous compositions EXXON CHEMICAL PATENTS INC. (US) 1988-10-26 EP disclosed
US-4776969-A WEAR RESISTANT, OXIDATIN RESISTANCE AND FRICTION MODIFYING OIL ADDITIVES EXXON CHEMICAL PATENTS INC. (US) 1988-10-11 US disclosed
US-4772406-A OIL ADDITIVES; HEAT AND OXIDATION RESISTANCE EXXON CHEMICAL PATENTS INC. (US) 1988-09-20 US disclosed
EP-0264247-A2 High functionality low molecular weight oil soluble dispersant additive useful in oleaginous compositions EXXON CHEMICAL PATENTS INC. (US) 1988-04-20 EP disclosed
EP-0263704-A2 Lactone modified, aminated dispersant additives useful in oleaginous compositions EXXON CHEMICAL PATENTS INC. (US) 1988-04-13 EP disclosed
EP-0263703-A2 Lactone modified, esterified or aminated additives useful in oleaginous compositions EXXON CHEMICAL PATENTS INC. (US) 1988-04-13 EP disclosed
EP-0263706-A2 Adducts or reactants modified with a lactone and oleaginous compositions containing same EXXON CHEMICAL PATENTS INC. (US) 1988-04-13 EP disclosed
EP-0263702-A2 Lactone modified, esterified dispersant additives useful in oleaginous compositions EXXON CHEMICAL PATENTS INC. (US) 1988-04-13 EP disclosed
EP-0240327-A2 Cyclic phosphate additives and their use in oleaginous compositions EXXON CHEMICAL PATENTS INC. (US) 1987-10-07 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 (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-11787760-B2 Process for making ethers via enol ethers ELOVL5, ELOVL1, ELOVL3 ALDH1A1 124/4885MAPK1 2394/4885POLB 998/4885

“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.