SCHEMBL4600642

SCHEMBL4600642

O=CC(Br)Cc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.54
LTA4H P09960 3/20 0.54
PPARG P37231 4/20 0.54
PPARA Q07869 3/20 0.54
FFAR1 O14842 1/20 0.53
FFAR4 Q5NUL3 1/20 0.53
MAOB P27338 3/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
CYP2C19 P33261 1/20 0.50
PTGS2 P35354 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HIF1A Q16665 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
LAP3 P28838 1/20 0.50
NR4A1 P22736 1/20 0.49
NR4A2 P43354 1/20 0.49
NR4A3 Q92570 1/20 0.49

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
SCHEMBL233264 0.83 EPHX1 (0.50) CYP1A2PTGS1SLC6A2SLC6A3LAP3
SCHEMBL9332536 0.82 LTA4H (0.61) BCHELTA4HPPARGPPARAFFAR1
SCHEMBL14279482 0.81 LTA4H (0.61) BCHELTA4HPPARGPPARAFFAR1
SCHEMBL7434755 0.81 LTA4H (0.61) BCHELTA4HPPARGPPARAFFAR1
SCHEMBL7426754 0.81 LTA4H (0.61) BCHELTA4HPPARGPPARAFFAR1
SCHEMBL41221 0.79 LMNA (0.51) BCHEMAOBLMNACYP1A2PTGS1
SCHEMBL28779138 0.78 PPARG (0.52) BCHELTA4HPPARGPPARAFFAR1
SCHEMBL11302697 0.78 PPARG (0.65) LTA4HPPARGPPARAFFAR1FFAR4
SCHEMBL5270401 0.77 BCHE (0.51) BCHELTA4HPPARGPPARAFFAR1
SCHEMBL13110181 0.77 BCHE (0.51) BCHELTA4HPPARGPPARAFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110627704-B Preparation method of bazedoxifene 艾瑞吉瑞股份公司 2024-02-23 CN disclosed
US-10844047-B2 Process for the preparation of bazedoxifene ERREGIERRE S.P.A. (IT) 2020-11-24 US disclosed
CN-110627704-A Preparation method of bazedoxifene 艾瑞吉瑞股份公司 2019-12-31 CN disclosed
EP-1915364-A1 PYRAZOLE DERIVATIVES AS THERAPEUTIC AGENTS AstraZeneca AB (SE) 2008-04-30 EP disclosed
EP-1910331-A1 PYRAZOLE DERIVATIVES AS CBl MODULATORS AstraZeneca AB (SE) 2008-04-16 EP disclosed
EP-1831177-A1 THERAPEUTIC AGENTS AstraZeneca AB (SE) 2007-09-12 EP disclosed
WO-2007020388-A1 PYRAZOLE DERIVATIVES AS THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2007-02-22 WO disclosed
WO-2007010217-A1 PYRAZOLE DERIVATIVES AS CBl MODULATORS ASTRAZENECA AB (SE) 2007-01-25 WO disclosed
EP-1718617-A2 3-SUBSTITUTED 1,5-DIPHENYLPYRAZOLE DERIVATIVES USEFUL AS CB1 MODULATORS3-SUBSTITUTED 1,5-DIPHENYLPYRAZOLE DERIVATIVES USEFUL AS CB1 MODULATORS AstraZeneca AB (SE) 2006-11-08 EP disclosed
WO-2006067443-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2006-06-29 WO disclosed
WO-2005080343-A2 3-SUBSTITUTED 1,5-DIPHENYLPYRAZOLE DERIVATIVES USEFUL AS CB1 MODULATORS ASTRAZENECA AB (SE) 2005-09-01 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 (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-10844047-B2 Process for the preparation of bazedoxifene CYP19A1, CYP3A5, CYP4A11 BCHE 172/4885LTA4H 884/4885PPARG 1394/4885

“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.