SCHEMBL5805891

SCHEMBL5805891

COc1cc(OC)cc(OS(=O)(=O)c2cc(N3CCN[C@H](C)C3)c3occc3c2)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.44
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
GHSR Q92847 6/20 0.33
BRPF1 P55201 2/20 0.33
ADRB1 P08588 1/20 0.33
BRD4 O60885 1/20 0.33
CYP1A1 P04798 1/20 0.33
PIN1 Q13526 1/20 0.33
HTR6 P50406 1/20 0.32
BIRC2 Q13490 1/20 0.32

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
SCHEMBL5806198 1.00 HTR2C (0.44) HTR2CALDH1A1LMNAGHSRBRPF1
SCHEMBL5824219 1.00 HTR2C (0.44) HTR2CALDH1A1LMNAGHSRBRPF1
Trifluoroacetic Acid SCHEMBL5955920 0.92 HTR2C (0.44) HTR2CALDH1A1BRPF1BRD4PIN1
Trifluoroacetic Acid SCHEMBL5954934 0.92 HTR2C (0.44) HTR2CALDH1A1BRPF1BRD4PIN1
SCHEMBL5803260 0.84 HTR2C (0.41) HTR2CGHSRBRPF1BRD4
SCHEMBL5805845 0.84 HTR2C (0.41) HTR2CGHSRBRPF1BRD4
SCHEMBL5804656 0.81 KDM4E (0.41) CYP1A1HTR6
Trifluoroacetic Acid SCHEMBL5955936 0.78 HTR2C (0.41) HTR2CALDH1A1GHSRBRPF1ADRB1
Trifluoroacetic Acid SCHEMBL5819864 0.78 HTR2C (0.41) HTR2CALDH1A1GHSRBRPF1ADRB1
Trifluoroacetic Acid SCHEMBL5814494 0.74 KDM4E (0.37) ALDH1A1CYP1A1HTR6

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 HTR2C 866/4885ALDH1A1 461/4885LMNA 3496/4885

“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.