SCHEMBL13640449

SCHEMBL13640449

COC(=O)N[C@H](CO)C(=O)NCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.62
CA1 P00915 1/20 0.62
CA2 P00918 1/20 0.62
CA3 P07451 1/20 0.62
CA4 P22748 1/20 0.62
CA6 P23280 1/20 0.62
CA5A P35218 1/20 0.62
CA7 P43166 1/20 0.62
CACNA1C Q13936 1/20 0.62
SCN9A Q15858 1/20 0.62
CA9 Q16790 1/20 0.62
CA13 Q8N1Q1 1/20 0.62
CA14 Q9ULX7 1/20 0.62
CA5B Q9Y2D0 1/20 0.62
MMP8 P22894 3/20 0.60
ALDH1A1 P00352 4/20 0.51
ATM Q13315 1/20 0.51
CYP2C9 P11712 4/20 0.51
CYP2C19 P33261 4/20 0.51
CYP2D6 P10635 3/20 0.51

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
SCHEMBL13584226 0.87 MMP8 (0.56) CA12CA1CA2CA3CA4
SCHEMBL13584223 0.87 MMP8 (0.56) CA12CA1CA2CA3CA4
SCHEMBL30968897 0.86 CTSS (0.62) CA12CA1CA2CA3CA4
SCHEMBL42634 0.86 CTSS (0.62) CA12CA1CA2CA3CA4
SCHEMBL9582823 0.86 CTSS (0.62) CA12CA1CA2CA3CA4
SCHEMBL13583903 0.86 CTSS (0.62) CA12CA1CA2CA3CA4
SCHEMBL1697358 0.86 CTSS (0.60) CA12CA1CA2CA3CA4
SCHEMBL2120048 0.86 CTSS (0.60) CA12CA1CA2CA3CA4
SCHEMBL2577057 0.85 MMP8 (0.60) CA12CA1CA2CA3CA4
SCHEMBL2577056 0.85 MMP8 (0.60) CA12CA1CA2CA3CA4

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-20120283466-A1 LACOSAMIDE INTERMEDIATE COMPOUND, PREPARATION METHOD THEREOF AND USE THEREOF ZHEJIANG JIUZHOU PHARMACEUTICAL CO., LTD. (CN) 2012-11-08 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-20120283466-A1 LACOSAMIDE INTERMEDIATE COMPOUND, PREPARATION METHOD THEREOF AND USE THEREOF IDH3A, CACNA1C, DDC CA12 221/4885CA1 78/4885CA2 45/4885

“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.