SCHEMBL962082

SCHEMBL962082

COCCc1sc(S(N)(=O)=O)c(C(=O)Nc2ncc(Br)s2)c1Cl

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 13/20 0.52
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
PKM P14618 1/20 0.41
RAB9A P51151 1/20 0.41
FPR2 P25090 1/20 0.40
SETD1B Q9UPS6 1/20 0.39
MAPK10 P53779 1/20 0.39

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
SCHEMBL959968 0.91 FBP1 (0.56) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4570017 0.85 FBP1 (0.57) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4570117 0.83 FBP1 (0.56) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4570506 0.80 FBP1 (0.56) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4566925 0.78 FBP1 (0.51) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL958486 0.77 FBP1 (0.53) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4570288 0.72 FBP1 (0.46) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL957160 0.72 FBP1 (0.80) FBP1
SCHEMBL962214 0.71 FBP1 (0.47) FBP1SMN1; SMN2NPC1LMNAPKM
SCHEMBL4569970 0.71 FBP1 (0.57) FBP1SMN1; SMN2NPC1LMNAPKM

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-7868030-B2 FBPase inhibitors for diabetes HOFFMANN-LA ROCHE INC. (US) 2011-01-11 US disclosed
EP-2032548-A1 THIAZOLE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2009-03-11 EP disclosed
WO-2007137962-A1 THIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-12-06 WO disclosed
US-20070281979-A1 Fructose-1,6-bisphosphatase (FBPase) inhibitors, such as N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]3(difluoromethoxy)benzenesulfonamide, used as antidiabetic agents HOFFMANN-LA ROCHE INC. 2007-12-06 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-20070281979-A1 Fructose-1,6-bisphosphatase (FBPase) inhibitors, such as N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]3(difluoromethoxy)benzenesulfonamide, used as antidiabetic agents FBP1, PFKFB1, PFKFB3 FBP1 1/4885SMN1; SMN2 3284/4885NPC1 1201/4885

“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.