SCHEMBL5507394

SCHEMBL5507394

O=S(=O)(O)CC(F)CNC1C2CC3CC(C2)CC1C3

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
EPHX2 P34913 9/20 0.36
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
DPP4 P27487 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL353069 0.82 HTR1A (0.38) CA1CA2EPHX2TDP1L3MBTL1
SCHEMBL18775726 0.78 HSD11B1 (0.37)
SCHEMBL5503709 0.74 EPHX2 (0.36) EPHX2TDP1L3MBTL1DPP4HSD17B10
SCHEMBL5506446 0.71 KDM4E (0.46) CA1LMNASMN1; SMN2
SCHEMBL5504913 0.71 ADRB3 (0.38) EPHX2DPP4SMN1; SMN2
SCHEMBL18747650 0.70 LMNA (0.46) CA1CA2EPHX2TDP1L3MBTL1
SCHEMBL5505906 0.70 KDM4E (0.48) CA1CA2EPHX2LMNASMN1; SMN2
SCHEMBL5506825 0.70 KDM4E (0.48) CA1CA2EPHX2LMNASMN1; SMN2
SCHEMBL13330072 0.68 LMNA (0.47) CA1CA2EPHX2TDP1L3MBTL1
SCHEMBL14100188 0.68 LMNA (0.47) CA1CA2EPHX2TDP1L3MBTL1

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
EP-1828111-A2 METHODS AND FLUORINATED COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES Neurochem (International) Limited (CH) 2007-09-05 EP disclosed
US-20060183800-A1 Methods and fluorinated compositions for treating amyloid-related diseases BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2006-08-17 US disclosed
WO-2006059252-A2 METHODS AND FLUORINATED COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2006-06-08 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-20060183800-A1 Methods and fluorinated compositions for treating amyloid-related diseases APP, PSEN1, TTR CA1 291/4885CA2 1329/4885EPHX2 312/4885

“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.