SCHEMBL5804656

SCHEMBL5804656

COc1cc(OC)cc(OS(=O)(=O)c2cc(N3CCN(C)CC3)c3occc3c2)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
TSHR P16473 1/20 0.41
CYP1A1 P04798 2/20 0.38
HTR6 P50406 9/20 0.37
GSK3B P49841 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
Trifluoroacetic Acid SCHEMBL5814494 0.91 KDM4E (0.37) KDM4ETSHRCYP1A1HTR6
SCHEMBL5803128 0.82 HRH4 (0.41) TSHRHTR6
SCHEMBL5804780 0.82 DRD2 (0.41) HTR6
SCHEMBL5824219 0.81 HTR2C (0.44) CYP1A1HTR6
SCHEMBL5805891 0.81 HTR2C (0.44) CYP1A1HTR6
SCHEMBL5806198 0.81 HTR2C (0.44) CYP1A1HTR6
SCHEMBL5803281 0.77 LMNA (0.39) TSHRCYP1A1L3MBTL1
Trifluoroacetic Acid SCHEMBL5824147 0.76 CDK2 (0.38) TSHRHTR6GSK3BL3MBTL1
Trifluoroacetic Acid SCHEMBL5818377 0.76 HTR1A (0.38) KDM4ETSHRHTR6
Trifluoroacetic Acid SCHEMBL5955920 0.75 HTR2C (0.44) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060142269-A1 New compounds BIOVITRUM AB (SE) 2006-06-29 US claimed
WO-2006062481-A1 NEW BENZOFURAN DERIVATIVES AND THEIR USE IN THE TREATMENT OF OBESITY, TYPE II DIABETES AND CNS DISORDERS . BIOVITRUM AB (SE) 2006-06-15 WO claimed
US-20060142269-A1 New compounds BIOVITRUM AB (SE) 2006-06-29 US disclosed
WO-2006062481-A1 NEW BENZOFURAN DERIVATIVES AND THEIR USE IN THE TREATMENT OF OBESITY, TYPE II DIABETES AND CNS DISORDERS . BIOVITRUM AB (SE) 2006-06-15 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-20060142269-A1 New compounds GPR119, GLP1R, IAPP KDM4E 3934/4885TSHR 572/4885CYP1A1 161/4885

“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.