SCHEMBL4247794

SCHEMBL4247794

O=S(=O)(OC[C@H]1COc2cc(Cl)ccc2O1)C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.55
CA1 P00915 1/20 0.55
FFAR1 O14842 16/20 0.46
CYP2C9 P11712 1/20 0.41
CYP2B6 P20813 1/20 0.41
SLCO1B3 Q9NPD5 1/20 0.41

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
SCHEMBL4247796 1.00 CA2 (0.55) CA2CA1FFAR1CYP2C9CYP2B6
SCHEMBL12056274 0.84 CA2 (0.65) CA2CA1FFAR1CYP2C9CYP2B6
SCHEMBL18728166 0.81 FFAR1 (0.51) CA2FFAR1
SCHEMBL27823267 0.80 CA2 (0.54) CA2CA1FFAR1CYP2C9CYP2B6
SCHEMBL1117923 0.79 CA2 (0.53) CA2CA1FFAR1CYP2C9CYP2B6
SCHEMBL13646367 0.79 CA2 (0.53) CA2CA1FFAR1CYP2C9CYP2B6
SCHEMBL9375647 0.79 CA2 (0.58) CA2CA1FFAR1CYP2C9CYP2B6
SCHEMBL17272320 0.77 CA2 (0.33) CA2FFAR1
SCHEMBL27816758 0.74 CA2 (0.70) CA2CA1FFAR1
SCHEMBL1044755 0.74 CA2 (0.53) CA2CA1FFAR1CYP2C9CYP2B6

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-20090182141-A1 PROCESS FOR THE PREPARATION OF SULFAMIDE DERIVATIVES JANSSEN PHARMACEUTICA, N.V. (BE) 2009-07-16 US disclosed
US-20090182141-A1 PROCESS FOR THE PREPARATION OF SULFAMIDE DERIVATIVES JANSSEN PHARMACEUTICA, N.V. (BE) 2009-07-16 US disclosed
US-20090182141-A1 PROCESS FOR THE PREPARATION OF SULFAMIDE DERIVATIVES JANSSEN PHARMACEUTICA, N.V. (BE) 2009-07-16 US disclosed
WO-2009089210-A1 PREPARATION OF SULFAMIDE DERIVATIVES JANSSEN PHARMACEUTICA N. V. (BE) 2009-07-16 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-20090182141-A1 PROCESS FOR THE PREPARATION OF SULFAMIDE DERIVATIVES STS, SULT2A1, SULT1A1 CA2 1188/4885CA1 404/4885FFAR1 1437/4885

“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.