SCHEMBL3391772

SCHEMBL3391772

CS(=O)(=O)c1ccc(C(=Cc2nccs2)C(=O)O)cc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 12/20 0.59
PTGS2 P35354 5/20 0.56
GCK P35557 1/20 0.54
AKR1C2 P52895 3/20 0.53
AKR1C1 Q04828 3/20 0.53

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
SCHEMBL2665983 1.00 AKR1C3 (0.59) AKR1C3PTGS2GCKAKR1C2AKR1C1
SCHEMBL3389108 0.84 GCK (0.76) GCK
SCHEMBL2666082 0.84 GCK (0.76) GCK
SCHEMBL2659815 0.76 GCK (0.65) AKR1C3PTGS2GCKAKR1C2AKR1C1
SCHEMBL2659818 0.76 GCK (0.65) AKR1C3PTGS2GCKAKR1C2AKR1C1
SCHEMBL2665984 0.74 AKR1C3 (0.59) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL3389220 0.74 AKR1C3 (0.59) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL2650989 0.73 AKR1C3 (0.71) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL2650983 0.73 AKR1C3 (0.71) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL24528887 0.73 ALDH1A1 (0.37) GCK

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
EP-2168962-A2 PHENYLACETAMIDES AND THEIR USE AS GLUCOKINASE MODULATORS Prosidion Limited (GB) 2010-03-31 EP disclosed
US-7582632-B2 Tri(cyclo) substituted amide compounds PROSIDION LIMITED (GB) 2009-09-01 US disclosed
US-20070281946-A1 TRI(CYCLO) SUBSTITUTED AMIDE COMPOUNDS OSI PHARMACEUTICALS, INC. 2007-12-06 US disclosed
US-7214681-B2 Tri(cyclo) substituted amide compounds PROSIDION LIMITED (GB) 2007-05-08 US 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-20070281946-A1 TRI(CYCLO) SUBSTITUTED AMIDE COMPOUNDS IAPP, GPR119, SLC5A1 AKR1C3 921/4885PTGS2 1720/4885GCK 70/4885

“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.