SCHEMBL14920568

SCHEMBL14920568

C[Si](C)(C)Oc1ccccc1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 12/20 0.42
DRD3 P35462 9/20 0.42
DRD4 P21917 7/20 0.42
DRD1 P21728 4/20 0.42
DRD5 P21918 4/20 0.42
HTR1D P28221 2/20 0.36
HTR5A P47898 1/20 0.36
CHRM1 P11229 1/20 0.34
ELANE P08246 1/20 0.33

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
SCHEMBL1712875 0.85 DRD2 (0.43) DRD2DRD3DRD4DRD1DRD5
SCHEMBL5599606 0.80 CA1 (0.50) DRD2DRD3DRD4DRD1DRD5
SCHEMBL29414143 0.80 CA1 (0.50) DRD2DRD3DRD4DRD1DRD5
SCHEMBL1713611 0.79 DRD2 (0.40) DRD2DRD3DRD4DRD1DRD5
SCHEMBL29607374 0.79 DRD2 (0.40) DRD2DRD3DRD4DRD1DRD5
SCHEMBL28142221 0.78 DRD2 (0.39) DRD2DRD3DRD4DRD1DRD5
SCHEMBL30706241 0.77 DRD2 (0.42) DRD2DRD3DRD4DRD1DRD5
SCHEMBL30665126 0.77 DRD2 (0.42) DRD2DRD3DRD4DRD1DRD5
SCHEMBL28726740 0.77 CXCR2 (0.44) DRD2DRD3DRD4DRD1DRD5
SCHEMBL2984151 0.77 DRD2 (0.42) DRD2DRD3DRD4DRD1DRD5

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
CN-115746046-A O-silyl substituted phenyl sulfonate and synthesis method and application thereof 杭州瀛拓科技有限公司 2023-03-07 CN disclosed
CN-114269717-A Catalytic cannabinoid processes and precursors 凯尔化学科技公司 2022-04-01 CN disclosed
US-20140288040-A1 SUBSTITUTED BENZYLAMINE COMPOUNDS, THEIR USE IN MEDICINE, AND IN PARTICULAR THE TREATMENT OF HEPATITIS C VIRUS (HCV) INFECTION ASTEX THERAPEUTICS LIMITED (GB) 2014-09-25 US disclosed
US-20140288040-A1 SUBSTITUTED BENZYLAMINE COMPOUNDS, THEIR USE IN MEDICINE, AND IN PARTICULAR THE TREATMENT OF HEPATITIS C VIRUS (HCV) INFECTION ASTEX THERAPEUTICS LIMITED (GB) 2014-09-25 US disclosed
US-20140288040-A1 SUBSTITUTED BENZYLAMINE COMPOUNDS, THEIR USE IN MEDICINE, AND IN PARTICULAR THE TREATMENT OF HEPATITIS C VIRUS (HCV) INFECTION ASTEX THERAPEUTICS LIMITED (GB) 2014-09-25 US disclosed
EP-2773613-A1 SUBSTITUTED BENZYLAMINE COMPOUNDS, THEIR USE IN MEDICINE, AND IN PARTICULAR THE TREATMENT OF HEPATITIS C VIRUS (HCV) INFECTION Astex Therapeutics Limited (GB) 2014-09-10 EP disclosed
WO-2013064538-A1 SUBSTITUTED BENZYLAMINE COMPOUNDS, THEIR USE IN MEDICINE, AND IN PARTICULAR THE TREATMENT OF HEPATITIS C VIRUS (HCV) INFECTION ASTEX THERAPEUTICS LIMITED (GB) 2013-05-10 WO disclosed
WO-2013064538-A1 SUBSTITUTED BENZYLAMINE COMPOUNDS, THEIR USE IN MEDICINE, AND IN PARTICULAR THE TREATMENT OF HEPATITIS C VIRUS (HCV) INFECTION ASTEX THERAPEUTICS LIMITED (GB) 2013-05-10 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-20140288040-A1 SUBSTITUTED BENZYLAMINE COMPOUNDS, THEIR USE IN MEDICINE, AND IN PARTICULAR THE TREATMENT OF HEPATITIS C VIRUS (HCV) INFECTION NR1H4, CFH, SLC10A1 DRD2 850/4885DRD3 859/4885DRD4 563/4885

“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.