SCHEMBL21813599

SCHEMBL21813599

COCC(C)NC(=O)OC1CCN(c2nc(C(F)(F)F)c3scc(C(=O)O)c3n2)CC1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ UGT8 Q16880 16/20 0.54
▸ RBP4 P02753 2/20 0.35
▸ TTR P02766 1/20 0.35
▸ LIPC P11150 1/20 0.34
▸ LIPG Q9Y5X9 1/20 0.34
▸ CCNE1 P24864 1/20 0.34
▸ CDK2 P24941 1/20 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
SCHEMBL21813597 1.00 UGT8 (0.54) UGT8RBP4TTRLIPCLIPG
SCHEMBL21862454 0.92 UGT8 (0.65) UGT8
SCHEMBL21862398 0.80 UGT8 (0.73) UGT8
SCHEMBL21813779 0.73 UGT8 (0.63) UGT8
SCHEMBL21813775 0.73 UGT8 (0.63) UGT8
SCHEMBL29233735 0.73 UGT8 (0.48) UGT8LIPCLIPGCCNE1CDK2
SCHEMBL21862438 0.70 UGT8 (1.00) UGT8
SCHEMBL30686905 0.70 UGT8 (1.00) UGT8
SCHEMBL21862452 0.70 UGT8 (1.00) UGT8
SCHEMBL21813578 0.68 UGT8 (0.67) UGT8

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-20200102324-A1 UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE GENZYME CORPORATION 2020-04-02 — — 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-20200102324-A1 UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE MAN2B1, GAA, GBA1 UGT8 74/4885RBP4 3894/4885TTR 3093/4885

“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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