SCHEMBL12205243

SCHEMBL12205243

FC(F)(F)c1ccc(Nc2cncc(NCC3CCNCC3)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 1/20 0.48
CHRNA3 P32297 1/20 0.48
CRHR1 P34998 4/20 0.46
CHEK1 O14757 1/20 0.42
FLT3 P36888 6/20 0.42
PIM1 P11309 1/20 0.40
HTR2C P28335 2/20 0.40
LIPC P11150 1/20 0.39
LIPG Q9Y5X9 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
SCHEMBL12245529 0.88 CHRNB4 (0.47) CHRNB4CHRNA3CRHR1LIPCLIPG
SCHEMBL12205232 0.86 CNR2 (0.46) CHRNB4CHRNA3CRHR1FLT3PIM1
SCHEMBL12205225 0.85 APP (0.51) CRHR1CHEK1FLT3PIM1
SCHEMBL12205337 0.82 CHEK1 (0.41) CHEK1PIM1
SCHEMBL12205189 0.80 CRHR1 (0.39) CRHR1CHEK1PIM1
SCHEMBL12205188 0.78 CHRNB4 (0.47) CHRNB4CHRNA3
SCHEMBL12205338 0.77 SYK (0.42) PIM1
SCHEMBL4925453 0.74 ROCK2 (0.45) FLT3PIM1
SCHEMBL12205230 0.73 APP (0.62) HTR2C
SCHEMBL12205340 0.71 APP (0.46) CHEK1PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110256064-A1 Novel Compounds for the Treatment of Diseases Associated with Amyloid or Amyloid-like Proteins AC IMMUNE, S.A. (CH) 2011-10-20 US disclosed
EP-2377860-A1 Novel compounds for the treatment of diseases associated with amyloid or amyloid-like proteins AC Immune S.A. (CH) 2011-10-19 EP 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-20110256064-A1 Novel Compounds for the Treatment of Diseases Associated with Amyloid or Amyloid-like Proteins APP, PSEN1, PSEN2 CHRNB4 193/4885CHRNA3 331/4885CRHR1 3581/4885

“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.