SCHEMBL13640515

SCHEMBL13640515

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nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.43
CTSS P25774 6/20 0.43
CTSL P07711 2/20 0.43
CTSB P07858 1/20 0.43
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 1/20 0.39
CAPN1 P07384 1/20 0.38
CYP2D6 P10635 1/20 0.38
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
PPARA Q07869 1/20 0.36

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
SCHEMBL17706118 0.89 CTSK (0.52) CTSKCTSSCTSLCTSBCA1
SCHEMBL7073369 0.88 CTSK (0.47) CTSKCTSSCTSLCTSBCA1
SCHEMBL14654976 0.81 TDP1 (0.47) CTSKCTSSCA1CA2GAA
SCHEMBL13086767 0.80 CTSS (0.57) CTSKCTSSCTSLCTSBPPARA
SCHEMBL11173165 0.80 CYP1A2 (0.48) CTSKCTSSCTSLCTSBCA1
SCHEMBL1846647 0.80 CYP1A2 (0.48) CTSKCTSSCTSLCTSBCA1
SCHEMBL2531297 0.80 CYP1A2 (0.48) CTSKCTSSCTSLCTSBCA1
SCHEMBL21096417 0.79 CTSK (0.42) CTSKCTSSCTSLCTSBCA1
SCHEMBL17706125 0.78 CTSK (0.58) CTSKCTSSCTSLCTSBPPARA
SCHEMBL3617926 0.78 CYP1A2 (0.47) CTSKCTSSCTSLCTSBCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8829226-B2 Lacosamide intermediate compound, preparation method thereof and use thereof ZHEJIANG JIUZHOU PHARMACEUTICAL CO., LTD (CN) 2014-09-09 US disclosed
US-20130066102-A1 LACOSAMIDE INTERMEDIATE COMPOUND, PREPARATION METHOD THEREOF AND USE THEREOF ZHEJIANG JIUZHOU PHARMACEUTICAL CO., LTD (CN) 2013-03-14 US disclosed
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 (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-20130066102-A1 LACOSAMIDE INTERMEDIATE COMPOUND, PREPARATION METHOD THEREOF AND USE THEREOF IDH3A, CACNA1C, DDC CTSK 1040/4885CTSS 590/4885CTSL 1174/4885
US-20120283466-A1 LACOSAMIDE INTERMEDIATE COMPOUND, PREPARATION METHOD THEREOF AND USE THEREOF IDH3A, CACNA1C, DDC CTSK 1040/4885CTSS 590/4885CTSL 1174/4885

“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.