SCHEMBL1255657

SCHEMBL1255657

Cc1cc(OC(CCCCNCc2cccc(-c3ccc(F)cc3)c2)C(=O)NO)ccc1F

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.67
KCNH2 Q12809 2/20 0.67

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
SCHEMBL1255653 1.00 CYP2D6 (0.67) CYP2D6KCNH2
SCHEMBL1257877 0.87 CYP2D6 (0.73) CYP2D6KCNH2
SCHEMBL1257875 0.87 CYP2D6 (0.73) CYP2D6KCNH2
SCHEMBL3924795 0.82 CYP2D6 (0.81) CYP2D6KCNH2
SCHEMBL3924801 0.82 CYP2D6 (0.81) CYP2D6KCNH2
SCHEMBL1255656 0.81 CYP2D6 (0.48) CYP2D6KCNH2
SCHEMBL3933779 0.81 CYP2D6 (0.48) CYP2D6KCNH2
SCHEMBL1258238 0.78 CYP2D6 (0.58) CYP2D6KCNH2
SCHEMBL3437179 0.78 CYP2D6 (0.62) CYP2D6KCNH2
SCHEMBL1258241 0.78 CYP2D6 (0.58) CYP2D6KCNH2

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-7879911-B2 2-(4-Fluorophenoxy-N-hydroxyacetamide where the \"oxy\" can also be sulfonyl, sulfamyl or sulfinyl; enzyme inhibitors of the \"lethal factor\" enzyme released by bacillus anthraci that splits an essential peptide needed by mammals for signal transmission; antidotes; biological warfare NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-02-01 US disclosed
US-20080188565-A1 Hydroxamic acid derivatives of phenoxy-acetic acids and analogs useful as therapeutic agents for treating anthrax poisoning PANTHERA BIOPHARMA, LLC 2008-08-07 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-20080188565-A1 Hydroxamic acid derivatives of phenoxy-acetic acids and analogs useful as therapeutic agents for treating anthrax poisoning ANTXR2, HAAO, PAOX CYP2D6 1567/4885KCNH2 2817/4885

“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.