SCHEMBL17237771

SCHEMBL17237771

COc1ccc(C=CC(=O)c2c(O)cc(OCc3ccccc3)cc2OCc2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC5A1 P13866 2/20 0.70
▸ SLC5A2 P31639 2/20 0.70
▸ APP P05067 1/20 0.68
▸ ABCG2 Q9UNQ0 2/20 0.67
▸ MAOB P27338 2/20 0.67
▸ MAPT P10636 3/20 0.66
▸ KMT2A Q03164 3/20 0.66
▸ CYP3A4 P08684 2/20 0.66
▸ TP53 P04637 1/20 0.66
▸ ATM Q13315 1/20 0.66
▸ HSD17B10 Q99714 1/20 0.66
▸ CYP19A1 P11511 1/20 0.61
▸ CYP2C9 P11712 1/20 0.61
▸ MAOA P21397 1/20 0.61
▸ CYP2C19 P33261 1/20 0.61
▸ NFKB1 P19838 1/20 0.61
▸ DPP4 P27487 1/20 0.61
▸ NFKB2 Q00653 1/20 0.61
▸ RELA Q04206 1/20 0.61
▸ GSK3B P49841 2/20 0.59

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
SCHEMBL25234616 1.00 SLC5A1 (0.70) SLC5A1SLC5A2APPABCG2MAOB
Ethane SCHEMBL25205522 0.93 SLC5A1 (0.77) SLC5A1SLC5A2APPABCG2MAOB
SCHEMBL4883627 0.93 SLC5A1 (0.80) SLC5A1SLC5A2APPABCG2MAOB
SCHEMBL13657210 0.93 SLC5A1 (0.80) SLC5A1SLC5A2APPABCG2MAOB
SCHEMBL30384783 0.93 SLC5A1 (0.80) SLC5A1SLC5A2APPABCG2MAOB
SCHEMBL30384339 0.93 SLC5A1 (0.80) SLC5A1SLC5A2APPABCG2MAOB
SCHEMBL17244808 0.92 SLC5A1 (0.64) SLC5A1SLC5A2APPABCG2MAOB
SCHEMBL25264975 0.91 MAPT (0.77) SLC5A1SLC5A2APPABCG2MAOB
SCHEMBL25192190 0.91 MAPT (0.77) SLC5A1SLC5A2APPABCG2MAOB
SCHEMBL1727986 0.91 SLC5A1 (0.72) SLC5A1SLC5A2APPABCG2MAOB

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-20150322033-A1 ANTIBACTERIAL AGENT JUNTENDO EDUCATIONAL FOUNDATION (JP) 2015-11-12 — — 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-20150322033-A1 ANTIBACTERIAL AGENT Q6ZSR9, MRPL21, NQO2 SLC5A1 2797/4885SLC5A2 2981/4885APP 4682/4885

“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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