SCHEMBL1861010

SCHEMBL1861010

COC(=O)C(CC1COC1)c1ccc(SC)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 9/20 0.39
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.34
LDHA P00338 1/20 0.33
LDHB P07195 1/20 0.33
EDNRA P25101 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
PHGDH O43175 1/20 0.32

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
SCHEMBL1861857 0.91 SLC6A3 (0.39) SLC6A3SLC6A2SLC6A4LDHALDHB
SCHEMBL2642370 0.89 SLC6A3 (0.40) SLC6A3SLC6A2SLC6A4LDHALDHB
SCHEMBL2645171 0.87 SLC6A3 (0.47) SLC6A3SLC6A2SLC6A4L3MBTL1
SCHEMBL2642542 0.82 SLC6A3 (0.37) SLC6A3SLC6A2SLC6A4
SCHEMBL1861422 0.81 KCNH2 (0.49) SLC6A3SLC6A2SLC6A4PHGDH
SCHEMBL1856163 0.81 SLC6A3 (0.46) SLC6A3L3MBTL1
SCHEMBL2642633 0.79 SLC6A3 (0.37) SLC6A3SLC6A2SLC6A4
SCHEMBL2647085 0.77 SLC6A3 (0.42) SLC6A3SLC6A2SLC6A4
SCHEMBL1865642 0.76 GCK (0.38) EDNRA
SCHEMBL2650793 0.75 SLC6A3 (0.58) SLC6A3SLC6A2SLC6A4

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-7935699-B2 Pyrazole glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2011-05-03 US disclosed
EP-2261216-A2 Pyrazoles as glucokinase activators F. Hoffmann-La Roche AG (CH) 2010-12-15 EP disclosed
EP-2046755-A2 PYRAZOLES AS GLUCOKINASE ACTIVATORS F. Hoffmann-Roche AG (CH) 2009-04-15 EP disclosed
WO-2008012227-A2 PYRAZOLES AS GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2008-01-31 WO disclosed
US-20080021032-A1 Pyrazole glucokinase activators BERTHEL STEVEN JOSEPH 2008-01-24 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-20080021032-A1 Pyrazole glucokinase activators GCKR, GCK, GALK1 SLC6A3 3386/4885SLC6A2 4146/4885SLC6A4 3293/4885

“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.