SCHEMBL2789595

SCHEMBL2789595

COc1cc(O)c(C(C)(C)C)cc1OC

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.80
TP53 P04637 3/20 0.80
CYP3A4 P08684 3/20 0.80
LMNA P02545 2/20 0.80
HPGD P15428 1/20 0.80
ALDH1A1 P00352 7/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
MAPT P10636 2/20 0.61
KDM4E B2RXH2 1/20 0.61
CYP1A2 P05177 1/20 0.61
ATP2A2 P16615 1/20 0.61
ATP2A3 Q93084 1/20 0.61
GAA P10253 1/20 0.49
CA2 P00918 4/20 0.48
CA1 P00915 3/20 0.48
HTT P42858 2/20 0.45
TYR P14679 2/20 0.45
NR1I2 O75469 1/20 0.45
CYP2C9 P11712 1/20 0.45
MIF P14174 1/20 0.45

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
SCHEMBL5082769 0.89 ALOX15 (0.84) ALOX15TP53CYP3A4LMNAHPGD
SCHEMBL29381356 0.89 ALOX15 (1.00) ALOX15TP53CYP3A4LMNAHPGD
SCHEMBL39215 0.89 ALOX15 (1.00) ALOX15TP53CYP3A4LMNAHPGD
SCHEMBL2741238 0.85 ALOX15 (0.71) ALOX15TP53CYP3A4LMNAHPGD
SCHEMBL20253183 0.84 ALOX15 (0.69) ALOX15TP53CYP3A4LMNAHPGD
SCHEMBL9631376 0.84 CYP3A4 (0.69) ALOX15TP53CYP3A4LMNAHPGD
SCHEMBL2946854 0.83 CYP3A4 (0.60) ALOX15TP53CYP3A4LMNAHPGD
SCHEMBL18198041 0.82 ALOX15 (0.79) ALOX15TP53CYP3A4LMNAHPGD
SCHEMBL158789 0.82 ALOX15 (0.80) ALOX15TP53CYP3A4LMNAHPGD
SCHEMBL29433129 0.82 ALOX15 (0.80) ALOX15TP53CYP3A4LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4448171-B1 TRANSITION METAL COMPLEX HYDROFORMYLATION CATALYST PRECUROR COMPOSITIONS COMPRISING SUCH COMPOUNDS, AND HYDROFORMYLATION PROCESSES DOW TECHNOLOGY INVESTMENTS LLC (US) 2025-08-20 EP disclosed
US-20240399349-A1 TRANSITION METAL COMPLEX HYDROFORMYLATION CATALYST PRECUROR COMPOSITIONS COMPRISING SUCH COMPOUNDS, AND HYDROFORMYLATION PROCESSES DOW TECHNOLOGY INVESTMENTS LLC (US) 2024-12-05 US disclosed
EP-4448171-A1 TRANSITION METAL COMPLEX HYDROFORMYLATION CATALYST PRECUROR COMPOSITIONS COMPRISING SUCH COMPOUNDS, AND HYDROFORMYLATION PROCESSES Dow Technology Investments LLC (US) 2024-10-23 EP disclosed
CN-118338965-A Transition metal complex hydroformylation catalyst precursor compositions comprising such compounds and hydroformylation process 陶氏技术投资有限责任公司 2024-07-12 CN disclosed
WO-2023114578-A1 TRANSITION METAL COMPLEX HYDROFORMYLATION CATALYST PRECUROR COMPOSITIONS COMPRISING SUCH COMPOUNDS, AND HYDROFORMYLATION PROCESSES DOW TECHNOLOGY INVESTMENTS LLC (US) 2023-06-22 WO disclosed
US-20100041657-A1 HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES NOVO NORDICK A/S (DK) 2010-02-18 US disclosed
EP-1881961-A1 NEW HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES NOVO NORDISK A/S (DK) 2008-01-30 EP disclosed
WO-2006120178-A1 NEW HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES NOVO NORDISK A/S (DK) 2006-11-16 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 (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-20100041657-A1 HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES RPS12, GPR119, ATP12A ALOX15 467/4885TP53 4503/4885CYP3A4 1149/4885
US-20240399349-A1 TRANSITION METAL COMPLEX HYDROFORMYLATION CATALYST PRECUROR COMPOSITIONS COMPRISING SUCH COMPOUNDS, AND HYDROFORMYLATION PROCESSES M6PR, KRAS, C1R ALOX15 1734/4885TP53 3095/4885CYP3A4 1417/4885

“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.