SCHEMBL4186360

SCHEMBL4186360

COc1ccc(S(=O)(=O)N2CCC(NS(=O)(=O)c3cccc4cccnc34)C2)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
MAPK1 P28482 2/20 0.56
POLB P06746 2/20 0.52
KMT2A Q03164 2/20 0.52
HTR1A P08908 1/20 0.51
DRD2 P14416 1/20 0.51
HTR7 P34969 1/20 0.51
HTR6 P50406 1/20 0.51
ALDH1A1 P00352 2/20 0.51
MCOLN3 Q8TDD5 1/20 0.51
GAA P10253 2/20 0.50
MEN1 O00255 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C19 P33261 1/20 0.50
RECQL P46063 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
GHSR Q92847 2/20 0.49
TSHR P16473 1/20 0.48

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
SCHEMBL13908402 0.85 POLB (0.49) LMNAMAPK1POLBKMT2AGAA
SCHEMBL4172989 0.81 PDE4A (0.64) MAPK1POLBALDH1A1GAATSHR
SCHEMBL4194160 0.81 PDE4A (0.64) MAPK1POLBALDH1A1GAATSHR
SCHEMBL4180198 0.81 PDE4A (0.64) MAPK1POLBALDH1A1GAATSHR
SCHEMBL4191674 0.76 ALOX15 (0.53) LMNAMAPK1POLBKMT2AALDH1A1
SCHEMBL4172976 0.75 PDE4A (0.69) MAPK1POLBKMT2AALDH1A1GAA
SCHEMBL4180103 0.74 PDE4A (0.71) MAPK1POLBKMT2AALDH1A1GAA
SCHEMBL1382478 0.72 ALDH1A1 (0.53) LMNAMAPK1POLBKMT2AALDH1A1
SCHEMBL4181513 0.72 ALDH1A1 (0.86) LMNAMAPK1POLBKMT2AALDH1A1
SCHEMBL3806662 0.72 ALDH1A1 (0.62) LMNAMAPK1KMT2AHTR1ADRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069302-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-03-12 US claimed
EP-1976498-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2008-10-08 EP claimed
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 claimed
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
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 LMNA 3674/4885MAPK1 1720/4885POLB 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.