SCHEMBL21029706

SCHEMBL21029706

CC(=O)[C@H]1CC[C@@H](O)[C@H](N)C1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GABRR1 P24046 1/20 0.31
▸ PLG P00747 1/20 0.30
▸ PLAT P00750 1/20 0.30
▸ LMNA P02545 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
SCHEMBL13631051 1.00 GABRR1 (0.31) GABRR1PLGPLATLMNA
SCHEMBL13631050 0.83 GABRR1 (0.31) GABRR1PLGPLATLMNA
SCHEMBL13806339 0.82 GABRR1 (0.33) GABRR1PLGPLATLMNA
SCHEMBL4109097 0.82 GABRR1 (0.50) GABRR1PLGPLATLMNA
SCHEMBL4428766 0.82 GABRR1 (0.50) GABRR1PLGPLATLMNA
SCHEMBL4428770 0.82 GABRR1 (0.50) GABRR1PLGPLATLMNA
SCHEMBL24690908 0.79 NAMPT (0.32) —
SCHEMBL24690910 0.79 NAMPT (0.32) —
SCHEMBL24690909 0.79 NAMPT (0.32) —
SCHEMBL24690457 0.79 NAMPT (0.32) —

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-10301322-B2 Processes for the preparation of edoxaban and intermediates thereof APOTEX INC. (CA) 2019-05-28 — — 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-10301322-B2 Processes for the preparation of edoxaban and intermediates thereof VKORC1, CYP2C9, VKORC1L1 GABRR1 1607/4885PLG 63/4885PLAT 147/4885

“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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