SCHEMBL25939647

SCHEMBL25939647

C=CCC(CC=C)(CC=C)CNC(=O)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(=O)NCC(CC=C)(CC=C)CC=C

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL30960862 0.96 ALDH1A1 (0.42) ALDH1A1
SCHEMBL29568177 0.86 ALDH1A1 (0.37) ALDH1A1
SCHEMBL29709957 0.82 ALDH1A1 (0.33) ALDH1A1
SCHEMBL25939658 0.77 ALDH1A1 (0.33) ALDH1A1
SCHEMBL23819885 0.76 ALDH1A1 (0.43) ALDH1A1
SCHEMBL29569089 0.75
SCHEMBL29569248 0.75
SCHEMBL29568835 0.73 ALDH1A1 (0.42) ALDH1A1
SCHEMBL29568756 0.73 ALDH1A1 (0.42) ALDH1A1
SCHEMBL30818040 0.73 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.