SCHEMBL12563864

SCHEMBL12563864

COC(=O)c1cc(OCCOCCOS(C)(=O)=O)cc(C(=O)OC)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.47
▸ RAB9A P51151 1/20 0.43
▸ ATM Q13315 1/20 0.38
▸ POLB P06746 4/20 0.38
▸ TDP1 Q9NUW8 3/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ KDM4E B2RXH2 6/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ LMNA P02545 3/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA7 P43166 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ CA14 Q9ULX7 1/20 0.38
▸ USP2 O75604 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ NFKB1 P19838 1/20 0.37

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
SCHEMBL14812151 0.89 MAPT (0.47) MAPTRAB9APOLBTDP1L3MBTL1
SCHEMBL12563828 0.87 MAPT (0.49) MAPTRAB9APOLBKDM4EALDH1A1
SCHEMBL16493139 0.86 MAPT (0.45) MAPTRAB9AATMPOLBTDP1
SCHEMBL3421285 0.82 MAPT (0.53) MAPTRAB9AATMPOLBTDP1
SCHEMBL12519176 0.82 MAPT (0.53) MAPTRAB9AATMPOLBTDP1
SCHEMBL25288186 0.82 MAPT (0.52) MAPTRAB9APOLBALDH1A1SMN1; SMN2
SCHEMBL13252830 0.81 CA12 (0.47) MAPTRAB9AATMTDP1L3MBTL1
SCHEMBL1964237 0.81 MAPT (0.75) MAPTRAB9ATDP1L3MBTL1KDM4E
SCHEMBL1989863 0.80 MAPT (0.54) MAPTRAB9AATMPOLBTDP1
SCHEMBL12733610 0.80 MAPT (0.54) MAPTRAB9AATMPOLBTDP1

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-20130022976-A1 HYPERTHERMOSTABLE ENDONUCLEASE IV SUBSTRATE PROBE ELITECH HOLDING B.V. 2013-01-24 — — US disclosed
US-20130022976-A1 HYPERTHERMOSTABLE ENDONUCLEASE IV SUBSTRATE PROBE ELITECH HOLDING B.V. 2013-01-24 — — US disclosed
US-20110151457-A1 HYPERTHEROMOSTABLE ENDONUCLEASE IV SUBSTRATE PROBE ELITECH HOLDING B.V. 2011-06-23 — — 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-20110151457-A1 HYPERTHEROMOSTABLE ENDONUCLEASE IV SUBSTRATE PROBE DNASE1, FEN1, UNG MAPT 3951/4885RAB9A 4477/4885ATM 2436/4885

“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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