SCHEMBL4187420

SCHEMBL4187420

COc1ccc(S(=O)(=O)N(C)C(C)C(C)N(C)S(=O)(=O)c2ccc(OC)c(OC)c2)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.58
TSHR P16473 1/20 0.58
MAPK1 P28482 1/20 0.58
MAPT P10636 2/20 0.51
KMT2A Q03164 1/20 0.49
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 2/20 0.46
HIF1A Q16665 2/20 0.46
EPAS1 Q99814 2/20 0.46
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45
GPBAR1 Q8TDU6 1/20 0.45
FFAR4 Q5NUL3 1/20 0.44

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
SCHEMBL4187131 0.83 TSHR (0.54) POLBTSHRMAPK1MAPTKMT2A
SCHEMBL7204252 0.82 MAPT (0.72) POLBTSHRMAPK1MAPTLMNA
SCHEMBL4187407 0.82 KMT2A (0.49) POLBTSHRMAPK1MAPTKMT2A
Hydrochloric Acid SCHEMBL4182141 0.82 TSHR (0.49) POLBTSHRMAPK1MAPTKMT2A
SCHEMBL4194203 0.79 KMT2A (0.59) TSHRMAPK1MAPTKMT2ALMNA
SCHEMBL4176914 0.78 PDE4D (0.61) POLBTSHRMAPK1MAPTKMT2A
SCHEMBL10633376 0.77 POLB (0.50) POLBTSHRMAPK1MAPTKMT2A
SCHEMBL7204680 0.77 TSHR (0.58) POLBTSHRMAPK1MAPTKMT2A
SCHEMBL13797482 0.75 POLB (0.66) POLBTSHRMAPK1KMT2ALMNA
SCHEMBL7204676 0.75 ALDH1A1 (0.77) POLBTSHRMAPK1MAPTLMNA

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 5 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
US-20090069302-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-03-12 US disclosed
US-20090069302-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-03-12 US disclosed
US-20090069302-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-03-12 US 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 POLB 4819/4885TSHR 576/4885MAPK1 1720/4885

“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.