SCHEMBL21994430

SCHEMBL21994430

O=C(Cl)OC(CCl)COCCCCOCC(CCl)OC(=O)Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 5/20 0.33
LPAR3 Q9UBY5 5/20 0.33
PLA2G2C Q5R387 2/20 0.33
USP2 O75604 1/20 0.32
TLR2 O60603 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTT P42858 1/20 0.32
LPAR5 Q9H1C0 4/20 0.31
LPAR6 P43657 3/20 0.31
LPAR4 Q99677 3/20 0.31
LPAR2 Q9HBW0 3/20 0.31
ADRA1D P25100 1/20 0.31
PTAFR P25105 1/20 0.31
HTR1D P28221 1/20 0.31
HTR2C P28335 1/20 0.31
ADRA1B P35368 1/20 0.31
DRD3 P35462 1/20 0.31
TMEM97 Q5BJF2 1/20 0.31

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
SCHEMBL26399949 0.92
SCHEMBL22272180 0.91 USP2 (0.38) LPAR1LPAR3PLA2G2CUSP2TLR2
SCHEMBL22322404 0.82 LPAR6 (0.31) LPAR1LPAR3LPAR5LPAR6LPAR4
SCHEMBL10914964 0.81 USP2 (0.50) LPAR1LPAR3PLA2G2CUSP2TLR2
SCHEMBL8048476 0.79 AR (0.31)
SCHEMBL8055213 0.78
SCHEMBL22657963 0.75 AR (0.34)
SCHEMBL10792974 0.74 HTT (0.39) LPAR1LPAR3PLA2G2CUSP2TLR2
SCHEMBL11244332 0.73 PLA2G2C (0.46) LPAR1LPAR3PLA2G2CUSP2TLR2
SCHEMBL10831321 0.73 EPHX1 (0.51) LPAR1LPAR3PLA2G2CUSP2TLR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12351563-B2 Reduction of the odor of monothiocarbonate compounds by addition of oxidants BASF SE (DE) 2025-07-08 US disclosed
US-12286510-B2 Coating composition or sealant comprising a compound with a five- membered cyclic monothiocarbonate group BASF SE (DE) 2025-04-29 US disclosed
EP-3887427-B1 COATING COMPOSITION OR SEALANT COMPRISING A COMPOUND WITH A FIVE-MEMBERED CYCLIC MONOTHIOCARBONAT GROUP BASF SE (DE) 2024-09-18 EP disclosed
CN-114245793-B Reduction of odor of monothiocarbonate compounds by addition of oxidizing agent 巴斯夫欧洲公司 2024-08-27 CN disclosed
EP-4013747-B1 REDUCTION OF THE ODOR OF MONOTHIOCARBONATE COMPOUNDS BY ADDITION OF OXIDANTS BASF SE (DE) 2024-04-03 EP disclosed
CN-113166403-B Coating composition or sealant comprising a compound having five-membered cyclic monothiocarbonate groups 巴斯夫欧洲公司 2023-12-15 CN disclosed
US-11518752-B2 Process for the purification of organic sulfur compounds BASF SE (DE) 2022-12-06 US disclosed
US-20220289697-A1 Reduction of the odor of monothiocarbonate compounds by addition of oxidants BASF SE (DE) 2022-09-15 US disclosed
US-20220267293-A1 PROCESS FOR THE PURIFICATION OF ORGANIC SULFUR COMPOUNDS BASF SE (DE) 2022-08-25 US disclosed
EP-4013746-A1 PROCESS FOR THE PURIFICATION OF ORGANIC SULFUR COMPOUNDS BASF SE (DE) 2022-06-22 EP disclosed
EP-4013747-A1 REDUCTION OF THE ODOR OF MONOTHIOCARBONATE COMPOUNDS BY ADDITION OF OXIDANTS BASF SE (DE) 2022-06-22 EP disclosed
EP-3887427-A1 COATING COMPOSITION OR SEALANT COMPRISING A COMPOUND WITH A FIVE-MEMBERED CYCLIC MONOTHIOCARBONAT GROUP BASF SE (DE) 2021-10-06 EP disclosed
WO-2020109053-A1 COATING COMPOSITION OR SEALANT COMPRISING A COMPOUND WITH A FIVE-MEMBERED CYCLIC MONOTHIOCARBONAT GROUP BASF SE (DE) 2020-06-04 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 (4 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-11518752-B2 Process for the purification of organic sulfur compounds TST, ABCB7, MSRB3 LPAR1 4814/4885LPAR3 4827/4885PLA2G2C 1923/4885
US-20220289697-A1 Reduction of the odor of monothiocarbonate compounds by addition of oxidants OR10J3, OR51E2, SQOR LPAR1 2276/4885LPAR3 2262/4885PLA2G2C 3422/4885
US-20220267293-A1 PROCESS FOR THE PURIFICATION OF ORGANIC SULFUR COMPOUNDS TST, ABCB7, MSRB3 LPAR1 4814/4885LPAR3 4827/4885PLA2G2C 1923/4885
US-12351563-B2 Reduction of the odor of monothiocarbonate compounds by addition of oxidants OR10J3, OR51E2, SQOR LPAR1 2276/4885LPAR3 2262/4885PLA2G2C 3422/4885

“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.