SCHEMBL25939615

SCHEMBL25939615

O=C(OC(F)(F)C(F)(F)C(F)(F)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)OC(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL30900641 0.94 ALDH1A1 (0.37) ALDH1A1
SCHEMBL30900633 0.94 ALDH1A1 (0.37) ALDH1A1
SCHEMBL30900631 0.86 ALDH1A1 (0.33) ALDH1A1
SCHEMBL30900639 0.85 ALDH1A1 (0.34) ALDH1A1
SCHEMBL29703165 0.83 ALDH1A1 (0.34) ALDH1A1
SCHEMBL22142472 0.79 ALDH1A1 (0.40) ALDH1A1
SCHEMBL593298 0.79 ALDH1A1 (0.40) ALDH1A1
SCHEMBL29367209 0.78 ALDH1A1 (0.42) ALDH1A1
SCHEMBL8471014 0.78 ALDH1A1 (0.39) ALDH1A1
SCHEMBL26936204 0.78 ALDH1A1 (0.42) ALDH1A1

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-20230250052-A1 SEPARATION METHOD AGC Inc. (JP) 2023-08-10 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-20230250052-A1 SEPARATION METHOD PFDN6, PCLAF, PFDN2 ALDH1A1 1446/4885

“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.