SCHEMBL6638877

SCHEMBL6638877

O=Cc1cc(-c2ccc(O)cc2)c(O)cc1O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ERN1 O75460 12/20 0.44
▸ PELI1 Q96FA3 1/20 0.43
▸ TRIM24 O15164 1/20 0.43
▸ TYR P14679 1/20 0.43
▸ TRIM33 Q9UPN9 1/20 0.43
▸ ESR1 P03372 2/20 0.42
▸ ESR2 Q92731 2/20 0.42
▸ ALDH5A1 P51649 1/20 0.41
▸ ABAT P80404 1/20 0.41

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
SCHEMBL28111651 0.85 ERN1 (0.47) ERN1PELI1ESR1ESR2ALDH5A1
SCHEMBL29076111 0.78 ERN1 (0.50) ERN1PELI1ESR1ESR2ALDH5A1
SCHEMBL8011498 0.78 HSD17B10 (0.50) ERN1PELI1ESR1ESR2ALDH5A1
SCHEMBL6640732 0.78 ERN1 (0.70) ERN1PELI1
SCHEMBL20873238 0.75 ALOX5 (0.56) PELI1TYRESR1ESR2
SCHEMBL10595101 0.75 ALOX5 (0.56) PELI1TYRESR1ESR2
SCHEMBL17625725 0.75 BACE1 (0.60) PELI1TYRESR1ESR2
SCHEMBL17660183 0.75 ERN1 (0.52) ERN1TRIM24TYRTRIM33
SCHEMBL9721340 0.74 ERN1 (0.46) ERN1PELI1ESR1ESR2ALDH5A1
Hydroquinone SCHEMBL11562733 0.74 ERN1 (0.59) ERN1TRIM24TRIM33ESR1ESR2

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-1412327-A2 INHIBITORS OF PROTEIN KINASE FOR THE TREATMENT OF DISEASE LG Biomedical Institute (US) 2004-04-28 — — EP disclosed
US-20030208067-A1 Inhibitors of protein kinase for the treatment of disease LG BIOMEDICAL INSTITUTE 2003-11-06 — — US disclosed
US-20030187007-A1 Inhibitors of protein kinase for the treatment of disease LG BIOMEDICAL INSTITUTE 2003-10-02 — — US disclosed
WO-2002096867-A2 INHIBITORS OF PROTEIN KINASE FOR THE TREATMENT OF DISEASE LG BIOMEDICAL INSTITUTE (US) 2002-12-05 — — 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 (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-20030208067-A1 Inhibitors of protein kinase for the treatment of disease MAP3K20, MAP3K1, MAP3K2 ERN1 446/4885PELI1 1219/4885TRIM24 1983/4885
US-20030187007-A1 Inhibitors of protein kinase for the treatment of disease MAP3K20, MAP3K1, MAP3K2 ERN1 446/4885PELI1 1219/4885TRIM24 1983/4885

“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.

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