SCHEMBL6009959

SCHEMBL6009959

Cc1ccc(C(NCCC(F)(F)S(=O)O)C(C)C)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 6/20 0.36
NFE2L2 Q16236 6/20 0.36
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
CNR1 P21554 2/20 0.32
CNR2 P34972 2/20 0.32
STAT3 P40763 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPT P10636 1/20 0.31
ACHE P22303 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
SCHEMBL5503942 0.76 KEAP1 (0.36) KEAP1NFE2L2CTSLCTSBCTSS
SCHEMBL5504083 0.71 KEAP1 (0.36) KEAP1NFE2L2CNR1CNR2STAT3
SCHEMBL6009956 0.69 HPGD (0.36) ALDH1A1SMN1; SMN2MAPT
SCHEMBL6009060 0.69 KEAP1 (0.37) KEAP1NFE2L2STAT3ALDH1A1LMNA
SCHEMBL17995187 0.63 KEAP1 (0.39) KEAP1NFE2L2ALDH1A1LMNASMN1; SMN2
SCHEMBL6008635 0.63 GRIA4 (0.40) KEAP1NFE2L2STAT3ALDH1A1LMNA
SCHEMBL13518307 0.63 KMT2A (0.51) KEAP1NFE2L2ALDH1A1LMNASMN1; SMN2
SCHEMBL5504957 0.62
SCHEMBL12320434 0.60 ACHE (0.39) CNR1CNR2STAT3ALDH1A1LMNA
SCHEMBL9728886 0.59 CHRNA7 (0.35) KEAP1NFE2L2CNR1CNR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060183800-A1 Methods and fluorinated compositions for treating amyloid-related diseases BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2006-08-17 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-20060183800-A1 Methods and fluorinated compositions for treating amyloid-related diseases APP, PSEN1, TTR KEAP1 1179/4885NFE2L2 2049/4885CTSL 610/4885

“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.