SCHEMBL3326162

SCHEMBL3326162

O=S(=O)(c1cccc(OC(F)(F)F)c1)n1ccc2cc(C3CNC3)ccc21

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 14/20 0.46
CYP3A4 P08684 3/20 0.46
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
FGFR4 P22455 1/20 0.41
AKR1C3 P42330 1/20 0.39
DRD3 P35462 1/20 0.39
PPARG P37231 2/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
EPHX2 P34913 1/20 0.37

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
Tert-Butyl Formate SCHEMBL27774753 0.92 HTR6 (0.42) HTR6CYP3A4POLBL3MBTL1FGFR4
SCHEMBL3328133 0.88 HTR6 (0.46) HTR6CYP3A4POLBL3MBTL1DRD3
SCHEMBL3327289 0.86 HTR6 (0.48) HTR6CYP3A4POLBL3MBTL1DRD3
SCHEMBL3325141 0.85 HTR6 (0.46) HTR6CYP3A4POLBL3MBTL1FGFR4
SCHEMBL3323074 0.85 HTR6 (0.56) HTR6CYP3A4POLBL3MBTL1DRD3
SCHEMBL3327051 0.84 HTR6 (0.45) HTR6CYP3A4POLBL3MBTL1DRD3
Tert-Butyl Formate SCHEMBL27774752 0.82 HTR6 (0.42) HTR6CYP3A4POLBL3MBTL1PPARG
SCHEMBL3323099 0.81 HTR6 (0.58) HTR6CYP3A4POLBL3MBTL1DRD3
SCHEMBL3328145 0.81 HTR6 (0.59) HTR6CYP3A4DRD3
SCHEMBL3325189 0.81 AKR1C3 (0.40) HTR6CYP3A4POLBL3MBTL1FGFR4

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-8507469-B2 Azetidin compounds suitable for treating disorders that respond to modulation of the serotonin 5-HT6 receptor ABBOTT GMBH & CO. KG (DE) 2013-08-13 US claimed
US-20100137280-A1 AZETIDIN COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR ABBOTT GMBH & CO. KG (DE) 2010-06-03 US claimed
US-8507469-B2 Azetidin compounds suitable for treating disorders that respond to modulation of the serotonin 5-HT6 receptor ABBOTT GMBH & CO. KG (DE) 2013-08-13 US disclosed
US-20100137280-A1 AZETIDIN COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR ABBOTT GMBH & CO. KG (DE) 2010-06-03 US 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-20100137280-A1 AZETIDIN COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR HTR6, HTR4, HTR3C HTR6 1/4885CYP3A4 398/4885POLB 4842/4885

“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.