SCHEMBL13624246

SCHEMBL13624246

N[C@@H](CCC(=O)OCc1ccccc1)CNc1ccc(N2CCOCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSL P07711 10/20 0.53
CTSK P43235 10/20 0.53
L3MBTL1 Q9Y468 1/20 0.50
CTSB P07858 7/20 0.49
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NPSR1 Q6W5P4 1/20 0.44
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
LIPE Q05469 1/20 0.42

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
SCHEMBL13624247 0.90 CTSL (0.54) CTSLCTSKL3MBTL1CTSBMAPT
SCHEMBL13624267 0.86 CTSL (0.56) CTSLCTSKL3MBTL1CTSBMAPT
SCHEMBL13624266 0.85 CTSL (0.60) CTSLCTSKL3MBTL1CTSBMAPT
SCHEMBL13624265 0.85 CTSL (0.54) CTSLCTSKL3MBTL1CTSBMAPT
SCHEMBL13624264 0.84 CTSL (0.53) CTSLCTSKL3MBTL1CTSBSMN1; SMN2
SCHEMBL13624253 0.82 L3MBTL1 (0.47) CTSLCTSKL3MBTL1CTSBMAPT
SCHEMBL30964173 0.79 MAPT (0.71) L3MBTL1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL30964184 0.77 MAPT (0.68) L3MBTL1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL29551592 0.77 ALDH1A1 (0.60) MAPTSMN1; SMN2MEN1KMT2ANPSR1
SCHEMBL13624252 0.75 MAPT (0.47) L3MBTL1MAPTSMN1; SMN2NPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090291945-A1 CYSTEINE PROTEASE INHIBITORS TEIJIN PHARMA LIMITED (JP) 2009-11-26 US disclosed
US-20090291945-A1 CYSTEINE PROTEASE INHIBITORS TEIJIN PHARMA LIMITED (JP) 2009-11-26 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-20090291945-A1 CYSTEINE PROTEASE INHIBITORS CTSE, SPINT2, CTSF CTSL 24/4885CTSK 15/4885L3MBTL1 3079/4885

“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.