SCHEMBL13554247

SCHEMBL13554247

O=c1c(OCCl)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 5/20 0.65
▸ MAPT P10636 4/20 0.65
▸ KDM4E B2RXH2 4/20 0.65
▸ RECQL P46063 4/20 0.65
▸ APEX1 P27695 3/20 0.65
▸ CYP3A4 P08684 3/20 0.65
▸ CYP2D6 P10635 3/20 0.65
▸ SLCO2B1 O94956 2/20 0.65
▸ ALDH1A1 P00352 2/20 0.65
▸ TDP1 Q9NUW8 2/20 0.65
▸ L3MBTL1 Q9Y468 2/20 0.65
▸ MEN1 O00255 2/20 0.65
▸ BLM P54132 2/20 0.65
▸ KMT2A Q03164 2/20 0.65
▸ HSD17B10 Q99714 2/20 0.65
▸ RGS12 O14924 1/20 0.65
▸ AKR1B10 O60218 1/20 0.65
▸ USP2 O75604 1/20 0.65
▸ CYP1A1 P04798 1/20 0.65
▸ APP P05067 1/20 0.65

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
SCHEMBL7914456 0.88 POLH (0.79) POLBMAPTKDM4ERECQLAPEX1
SCHEMBL10041306 0.83 POLB (0.77) POLBMAPTKDM4ERECQLAPEX1
Myricetin SCHEMBL29357150 0.80 MEN1 (1.00) POLBMAPTKDM4ERECQLAPEX1
Myricetin SCHEMBL19302 0.80 MEN1 (1.00) POLBMAPTKDM4ERECQLAPEX1
Myricetin SCHEMBL3503992 0.80 MEN1 (1.00) POLBMAPTKDM4ERECQLAPEX1
SCHEMBL6685824 0.79 EPHX2 (0.85) POLBMAPTKDM4ERECQLAPEX1
SCHEMBL13552041 0.76 MEN1 (0.76) POLBMAPTKDM4ERECQLAPEX1
SCHEMBL3777085 0.76 EPHX2 (0.80) POLBMAPTKDM4ERECQLAPEX1
SCHEMBL10728956 0.76 POLH (1.00) POLBMAPTKDM4ERECQLAPEX1
SCHEMBL7202826 0.76 POLH (1.00) POLBMAPTKDM4ERECQLAPEX1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120270821-A1 CDK5 Inhibitors and Therapeutic Uses Thereof THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2012-10-25 — — US disclosed
US-20090124688-A1 Prostaglandin reductase inhibitors ABGENOMICS CORPORATION (TW) 2009-05-14 — — 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 (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-20090124688-A1 Prostaglandin reductase inhibitors PTGIR, PTGDR, PTGDR2 POLB 1803/4885MAPT 4718/4885KDM4E 2123/4885
US-20120270821-A1 CDK5 Inhibitors and Therapeutic Uses Thereof CDK5, CDK3, CDKL1 POLB 1107/4885MAPT 348/4885KDM4E 1676/4885

“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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