SCHEMBL12119657

SCHEMBL12119657

CNC(=O)c1cccc(CNC(=O)c2cccc3c(N(CC(=O)OC(C)(C)C)S(=O)(=O)c4cc(Cl)cc(Cl)c4)cccc23)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 3/20 0.38
HTT P42858 1/20 0.36
RORC P51449 1/20 0.36
WDR5 P61964 1/20 0.35
APEX1 P27695 1/20 0.35
POLB P06746 1/20 0.35
AURKA O14965 1/20 0.35
RPS6KB1 P23443 1/20 0.35
AURKB Q96GD4 1/20 0.35
GAA P10253 2/20 0.35
MEN1 O00255 1/20 0.35
PLA2G1B P04054 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
KEAP1 Q14145 2/20 0.34

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
SCHEMBL12119698 0.93 EPHX2 (0.38) PTGER1HTTRORCMEN1CYP1A2
SCHEMBL12119184 0.92 F10 (0.39) PTGER1HTTRORCAPEX1GAA
SCHEMBL12119228 0.92 PTGER1 (0.38) PTGER1HTTWDR5APEX1GAA
SCHEMBL13658675 0.89 PTGER1 (0.39) PTGER1HTTAPEX1GAAMEN1
SCHEMBL1318023 0.89 KEAP1 (0.45) PTGER1HTTWDR5APEX1POLB
SCHEMBL12119303 0.88 PTGER1 (0.46) PTGER1HTTAPEX1POLBGAA
SCHEMBL1110482 0.87 SMN1; SMN2 (0.40) PTGER1HTTPOLBMEN1CYP2C19
SCHEMBL12119335 0.87 PTGER1 (0.38) PTGER1HTTAPEX1KEAP1NFE2L2
SCHEMBL12119625 0.87 EPHX2 (0.38) PTGER1HTTRORCKEAP1NFE2L2
SCHEMBL12119336 0.86 HTT (0.41) PTGER1HTTRORCPOLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269761-A1 ARYLSULPHONYLGLYCINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-03 US disclosed
WO-2009127723-A1 NEW ARYLSULPHONYLGLYCINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-10-22 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-20110269761-A1 ARYLSULPHONYLGLYCINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS SULT2A1, UGT1A1, SLC5A1 PTGER1 133/4885HTT 2848/4885RORC 309/4885

“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.