SCHEMBL20198740

SCHEMBL20198740

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nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL19432792 0.86 ALDH1A1 (0.35) ALDH1A1
SCHEMBL14404728 0.84 ALDH1A1 (0.45) ALDH1A1
SCHEMBL9609323 0.84 ALDH1A1 (0.33) ALDH1A1
SCHEMBL19982098 0.83 ALDH1A1 (0.36) ALDH1A1
SCHEMBL13510807 0.82 ALDH1A1 (0.32) ALDH1A1
SCHEMBL19981729 0.82 ALDH1A1 (0.35) ALDH1A1
SCHEMBL10051611 0.80 ALDH1A1 (0.41) ALDH1A1
SCHEMBL19051253 0.80 ALDH1A1 (0.41) ALDH1A1
SCHEMBL19340475 0.80 ALDH1A1 (0.33) ALDH1A1
SCHEMBL19340305 0.80 ALDH1A1 (0.30) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11771775-B2 Pyrrolobenzodiazepine-antibody conjugates MEDIMMUNE LIMITED (GB) 2023-10-03 US disclosed
US-20200345861-A1 PYRROLOBENZODIAZEPINE-ANTIBODY CONJUGATES BLUE OWL OPPORTUNISTIC MASTER FUND I, L.P. (FORMERLY KNOWN AS OWL ROCK OPPORTUNISTIC MASTER FUND I, L.P.) 2020-11-05 US disclosed
EP-2863863-B1 REDUCTION OF TOOTH STAINING DERIVED FROM CATIONIC ANTIMICROBIALS PROCTER & GAMBLE (US) 2018-05-30 EP 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 (2 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-20200345861-A1 PYRROLOBENZODIAZEPINE-ANTIBODY CONJUGATES CD79B, BCL6B, BCL6 ALDH1A1 3769/4885
US-11771775-B2 Pyrrolobenzodiazepine-antibody conjugates CD79B, BCL6B, BCL6 ALDH1A1 3769/4885

“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.