SCHEMBL30552802

SCHEMBL30552802

FC(F)c1nn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1I

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.32
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 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
SCHEMBL23210442 0.81 AURKA (0.32) AURKACYP11B1CYP11B2
SCHEMBL30552875 0.77 AURKA (0.30) AURKA
SCHEMBL22405796 0.75 ALDH1A1 (0.38) AURKACYP11B1CYP11B2
SCHEMBL28916303 0.75 AURKA (0.39) AURKACYP11B1CYP11B2
SCHEMBL28916306 0.71 AURKA (0.32) AURKACYP11B1CYP11B2
SCHEMBL29286714 0.71 ALDH1A1 (0.37) AURKACYP11B1CYP11B2
SCHEMBL25433636 0.71 AURKA (0.34) AURKACYP11B1CYP11B2
SCHEMBL27865251 0.68 AURKA (0.41) AURKACYP11B1CYP11B2
SCHEMBL3847403 0.67 ALDH1A1 (0.36)
SCHEMBL28916239 0.66 MAPT (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4482583-B1 ZWITTERIONIC ANTIBACTERIAL COMPOUNDS HOFFMANN LA ROCHE (CH) 2026-04-01 EP disclosed
US-20250179066-A1 ZWITTERIONIC ANTIBACTERIAL COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-06-05 US disclosed
EP-4482583-A1 ZWITTERIONIC ANTIBACTERIAL COMPOUNDS F. Hoffmann-La Roche AG (CH) 2025-01-01 EP disclosed
WO-2023161316-A1 ZWITTERIONIC ANTIBACTERIAL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-08-31 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-20250179066-A1 ZWITTERIONIC ANTIBACTERIAL COMPOUNDS MRPL21, WIZ, CFTR AURKA 1565/4885CYP11B1 1716/4885CYP11B2 1391/4885

“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.