SCHEMBL4159772

SCHEMBL4159772

c1csc(SCc2cn[nH]c2)n1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.44
FBP1 P09467 7/20 0.42
PDK1 Q15118 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
NAMPT P43490 1/20 0.36
HSD17B3 P37058 1/20 0.34
FDPS P14324 1/20 0.33

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
SCHEMBL4317683 0.74 HTR7 (0.39) HTR7FBP1PDK1SMN1; SMN2
SCHEMBL3074468 0.72 HSD17B10 (0.55) HTR7FBP1PDK1SMN1; SMN2
SCHEMBL8797344 0.69 HTR7 (0.46) HTR7FBP1PDK1SMN1; SMN2HSD17B3
SCHEMBL8796942 0.69 FBP1 (0.57) HTR7FBP1PDK1SMN1; SMN2
SCHEMBL15560767 0.67 NAMPT (0.34) NAMPT
SCHEMBL2892962 0.67 NAMPT (0.37) NAMPT
SCHEMBL13495875 0.66
SCHEMBL9885798 0.66
SCHEMBL21618552 0.66
SCHEMBL5248427 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090048112-A1 Novel Herbicides SYNGENTA LIMITED (GB) 2009-02-19 US disclosed
EP-1885720-A2 4-(THIAZOL-2-YLTHIOALKYL)-PYRAZOLES AND THEIR USE AS HERBICIDES Syngenta Limited (GB) 2008-02-13 EP disclosed
WO-2006123088-A2 4- (THIAZOL-2-YLTHIOALKYL) -PYRAZOLES AND THEIR USE AS HERBICIDES SYNGENTA LIMITED (GB) 2006-11-23 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-20090048112-A1 Novel Herbicides HAX1, MTX1, CYP4X1 HTR7 1957/4885FBP1 484/4885PDK1 1584/4885

“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.