SCHEMBL4883621

SCHEMBL4883621

O=C(/C=C/c1c(O)cc(OCc2ccccc2)cc1OCc1ccccc1)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 2/20 0.65
▸ PTPN1 P18031 1/20 0.60
▸ MAOB P27338 3/20 0.59
▸ SLC5A1 P13866 1/20 0.56
▸ SLC5A2 P31639 1/20 0.56
▸ APP P05067 1/20 0.52
▸ NR4A1 P22736 1/20 0.51
▸ NR4A2 P43354 1/20 0.51
▸ NR4A3 Q92570 1/20 0.51
▸ MEN1 O00255 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ BLM P54132 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ CYSLTR2 Q9NS75 1/20 0.49
▸ CYSLTR1 Q9Y271 1/20 0.49
▸ PARP10 Q53GL7 1/20 0.49
▸ GSK3B P49841 1/20 0.48
▸ BACE1 P56817 1/20 0.48

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
SCHEMBL5318918 1.00 ABCG2 (0.65) ABCG2PTPN1MAOBSLC5A1SLC5A2
SCHEMBL17237769 0.93 MAOB (0.67) ABCG2PTPN1MAOBSLC5A1SLC5A2
SCHEMBL4414036 0.88 ABCG2 (0.50) ABCG2PTPN1MAOBSLC5A1SLC5A2
SCHEMBL8064391 0.85 PTPN1 (0.56) ABCG2PTPN1MAOBAPPMEN1
SCHEMBL27630436 0.84 ABCG2 (0.50) ABCG2PTPN1MAOBSLC5A1SLC5A2
SCHEMBL8052936 0.83 PTPN1 (0.57) ABCG2PTPN1MAOBAPPMEN1
SCHEMBL3046006 0.83 ABCG2 (0.64) ABCG2PTPN1MAOBSLC5A1SLC5A2
SCHEMBL13029337 0.83 ABCG2 (0.64) ABCG2PTPN1MAOBSLC5A1SLC5A2
SCHEMBL27650595 0.83 ABCG2 (0.53) ABCG2PTPN1MAOBSLC5A1SLC5A2
SCHEMBL27705775 0.82 MAOB (0.71) ABCG2PTPN1MAOBAPPMEN1

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-20080269144-A1 Synthesis of Inhibitors of P90Rsk UNIVERSITY OF VIRGINIA PATENT FOUNDATION 2008-10-30 — — 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-20080269144-A1 Synthesis of Inhibitors of P90Rsk RAF1, KSR1, STK10 ABCG2 944/4885PTPN1 2610/4885MAOB 4209/4885

“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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