SCHEMBL16648571

SCHEMBL16648571

CC(=O)O[C@H]1OC(COCc2ccccc2)(C(CC(C)(C)C)O[SiH](c2ccccc2)c2ccccc2)[C@@H](OCc2ccccc2)[C@H]1OC(C)=O

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KLK7 P49862 2/20 0.33
▸ KLK5 Q9Y337 1/20 0.33
▸ NT5E P21589 1/20 0.33
▸ LMNA P02545 1/20 0.31
▸ CTSL P07711 1/20 0.31
▸ CTSB P07858 1/20 0.31
▸ CTSS P25774 1/20 0.31
▸ PTPN1 P18031 3/20 0.30
▸ CDC25B P30305 3/20 0.30
▸ PTPN2 P17706 2/20 0.30
▸ CDC25A P30304 1/20 0.30
▸ ALDH1A1 P00352 2/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30

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
SCHEMBL25435703 0.83 ALDH1A1 (0.36) NT5ELMNAALDH1A1CYP2D6MAPK1
SCHEMBL19492149 0.83 ALDH1A1 (0.36) NT5ELMNAALDH1A1CYP2D6MAPK1
SCHEMBL30689540 0.80 ALDH1A1 (0.35) NT5ELMNAPTPN1CDC25BALDH1A1
SCHEMBL16648568 0.78 — —
SCHEMBL20394059 0.76 BCHE (0.39) LMNAPTPN1CDC25BALDH1A1CYP2D6
SCHEMBL30590064 0.75 LMNA (0.39) NT5ELMNAALDH1A1CYP2D6MAPK1
SCHEMBL19101763 0.75 LMNA (0.39) NT5ELMNAALDH1A1CYP2D6MAPK1
SCHEMBL26121971 0.75 LMNA (0.39) NT5ELMNAALDH1A1CYP2D6MAPK1
SCHEMBL20756448 0.74 ALDH1A1 (0.37) NT5ELMNAALDH1A1CYP2D6MAPK1
SCHEMBL23152976 0.74 ALDH1A1 (0.37) NT5ELMNAALDH1A1CYP2D6MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2862868-B1 INTERMEDIATE FOR PRODUCTION OF NUCLEOSIDE ANALOGUE, AND METHOD FOR PRODUCING SAME DAIICHI SANKYO CO LTD (JP) 2020-04-08 — — EP disclosed
US-9738681-B2 Intermediate for production of nucleoside analog and method for producing the same DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-08-22 — — US disclosed
US-20160068561-A9 Intermediate for Production of Nucleoside Analog and Method for Producing the Same DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-03-10 — — US disclosed
US-20150152132-A1 Intermediate for Production of Nucleoside Analog and Method for Producing the Same DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-06-04 — — US disclosed
EP-2862868-A1 INTERMEDIATE FOR PRODUCTION OF NUCLEOSIDE ANALOGUE, AND METHOD FOR PRODUCING SAME DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-04-22 — — EP 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-20150152132-A1 Intermediate for Production of Nucleoside Analog and Method for Producing the Same RNGTT, NSUN2, RNMT KLK7 2233/4885KLK5 2472/4885NT5E 183/4885
US-20160068561-A9 Intermediate for Production of Nucleoside Analog and Method for Producing the Same RNGTT, NSUN2, RNMT KLK7 2233/4885KLK5 2472/4885NT5E 183/4885

“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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