SCHEMBL24499108

SCHEMBL24499108

C#C[C@]1(COCc2ccccc2)OC(n2cc(C)c(=O)[nH]c2=O)C(OC(C)=O)C1OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TK1 P04183 5/20 0.38
▸ RNASE1 P07998 1/20 0.36
▸ HPGD P15428 1/20 0.35
▸ NT5E P21589 1/20 0.35
▸ NT5M Q9NPB1 1/20 0.35
▸ BCHE P06276 1/20 0.34
▸ TYMP P19971 1/20 0.34
▸ TK2 O00142 3/20 0.34

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
SCHEMBL24244831 1.00 TK1 (0.38) TK1RNASE1HPGDNT5ENT5M
SCHEMBL24244849 1.00 TK1 (0.38) TK1RNASE1HPGDNT5ENT5M
SCHEMBL22609161 0.88 TK1 (0.36) TK1RNASE1HPGDNT5MBCHE
SCHEMBL22609159 0.88 TK1 (0.36) TK1RNASE1HPGDNT5MBCHE
SCHEMBL23054795 0.88 TK1 (0.36) TK1RNASE1HPGDNT5MBCHE
SCHEMBL13396754 0.88 NT5E (0.43) NT5E
SCHEMBL7214746 0.88 NT5E (0.43) NT5E
SCHEMBL7209722 0.88 NT5E (0.43) NT5E
SCHEMBL22609149 0.88 TK1 (0.43) TK1HPGDNT5ETK2
SCHEMBL21085681 0.88 TK1 (0.43) TK1HPGDNT5ETK2

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-20220177509-A1 PRODUCTION OF BRIDGED ARTIFICIAL NUCLEOSIDES NIPPON SHOKUBAI CO., LTD. (JP) 2022-06-09 — — 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-20220177509-A1 PRODUCTION OF BRIDGED ARTIFICIAL NUCLEOSIDES TYMP, PNP, TYMS TK1 78/4885RNASE1 200/4885HPGD 680/4885

“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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