SCHEMBL4182155

SCHEMBL4182155

COc1ccc(S(=O)(=O)N2CCCCC(N(C)S(=O)(=O)c3ccc(OC)c(OC)c3)C2)cc1OC

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.62
GPBAR1 Q8TDU6 1/20 0.58
ALDH1A1 P00352 4/20 0.58
LMNA P02545 3/20 0.58
GAA P10253 2/20 0.58
TSHR P16473 2/20 0.52
MCOLN3 Q8TDD5 3/20 0.50
CYP19A1 P11511 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
EPHX2 P34913 1/20 0.49
ATM Q13315 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL4180157 0.92 POLB (0.57) POLBGPBAR1ALDH1A1LMNAGAA
SCHEMBL4179427 0.92 POLB (0.57) POLBGPBAR1ALDH1A1LMNAGAA
SCHEMBL4177341 0.92 POLB (0.57) POLBGPBAR1ALDH1A1LMNAGAA
SCHEMBL4190644 0.83 POLB (0.66) POLBGPBAR1ALDH1A1LMNAGAA
SCHEMBL4181758 0.80 POLB (0.56) POLBGPBAR1TSHRCYP19A1MEN1
SCHEMBL7209087 0.79 GPBAR1 (0.91) POLBGPBAR1ALDH1A1LMNATSHR
SCHEMBL4184648 0.79 POLB (0.57) POLBGPBAR1TSHRCYP19A1MEN1
SCHEMBL4180062 0.79 POLB (0.57) POLBGPBAR1TSHRCYP19A1MEN1
SCHEMBL4174455 0.79 POLB (0.57) POLBGPBAR1TSHRCYP19A1MEN1
SCHEMBL7205052 0.78 GPBAR1 (0.88) GPBAR1ALDH1A1LMNATSHRMCOLN3

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-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 4819/4885GPBAR1 81/4885ALDH1A1 669/4885

“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.