SCHEMBL4180168

SCHEMBL4180168

COc1ccc(S(=O)(=O)N2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
MAPK14 Q16539 2/20 0.48
POLB P06746 2/20 0.48
GPBAR1 Q8TDU6 1/20 0.47
NR3C1 P04150 1/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
LMNA P02545 1/20 0.45

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
SCHEMBL4184732 0.85 GPBAR1 (0.61) L3MBTL1POLBGPBAR1CYP3A4CYP2C19
SCHEMBL4182164 0.85 GPBAR1 (0.61) L3MBTL1POLBGPBAR1CYP3A4CYP2C19
SCHEMBL4184730 0.85 GPBAR1 (0.61) L3MBTL1POLBGPBAR1CYP3A4CYP2C19
SCHEMBL4186414 0.80 GPBAR1 (0.52) L3MBTL1POLBGPBAR1CYP3A4CYP2C19
SCHEMBL4169679 0.79 ALDH1A1 (0.57) L3MBTL1POLBGPBAR1CYP3A4CYP2C19
SCHEMBL4174339 0.79 GPBAR1 (0.51) L3MBTL1POLBGPBAR1CYP3A4CYP2C19
SCHEMBL4177315 0.78 GPBAR1 (0.53) L3MBTL1POLBGPBAR1CYP3A4CYP2C19
SCHEMBL4176872 0.78 GPBAR1 (0.53) L3MBTL1POLBGPBAR1CYP3A4CYP2C19
SCHEMBL4187068 0.74 GLRA3 (0.63) L3MBTL1GPBAR1
SCHEMBL4180216 0.74 PKM (0.58) GPBAR1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069302-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-03-12 US disclosed
EP-1976498-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2008-10-08 EP disclosed
WO-2007127505-A2 USE OF SULFONAMIDE DERIVATIVES IN THE TREATMENT OF DISORDERS OF THE METABOLISM AND THE NERVOUS SYSTEM SMITHKLINE BEECHAM CORPORATION (US) 2007-11-08 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-20090069302-A1 CHEMICAL COMPOUNDS TBXA2R, PDE4D, PDE4A L3MBTL1 4391/4885MAPK14 2339/4885POLB 4819/4885

“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.