SCHEMBL7897252

SCHEMBL7897252

FC(F)(F)c1ccccc1OCC1CCCN1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 2/20 0.63
CHRNA3 P32297 2/20 0.63
CHRNB2 P17787 1/20 0.57
CHRNA4 P43681 1/20 0.57
LTA4H P09960 6/20 0.50

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
SCHEMBL11448820 0.86 CHRNB4 (0.47) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL19618884 0.86 CHRNB4 (0.68) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL3113146 0.86 CHRNB4 (0.68) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL17955434 0.86 CHRNB4 (0.68) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL11457902 0.82 PIM1 (0.45) CHRNB4CHRNA3LTA4H
SCHEMBL30785484 0.82 LTA4H (0.51) CHRNB4CHRNA3LTA4H
SCHEMBL5260158 0.81 CHRNB4 (0.48) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL2202866 0.81 CHRNB4 (0.68) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL2202872 0.81 CHRNB4 (0.68) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL25186844 0.78 CTSS (0.47) CHRNB2CHRNA4

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-20120053165-A1 Novel Phenyl Imidazoles and Phenyl Triazoles As Gamma-Secretase Modulators PFIZER INC. (US) 2012-03-01 US disclosed
US-20120053165-A1 Novel Phenyl Imidazoles and Phenyl Triazoles As Gamma-Secretase Modulators PFIZER INC. (US) 2012-03-01 US disclosed
WO-2010100606-A1 NOVEL PHENYL IMIDAZOLES AND PHENYL TRIAZOLES AS GAMMA-SECRETASE MODULATORS PFIZER INC. (US) 2010-09-10 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-20120053165-A1 Novel Phenyl Imidazoles and Phenyl Triazoles As Gamma-Secretase Modulators BACE1, BACE2, PSEN1 CHRNB4 139/4885CHRNA3 121/4885CHRNB2 143/4885

“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.