SCHEMBL13624281

SCHEMBL13624281

CC[C@@H](CNc1ccc(N(C)C)cc1)NC(=O)C1(NC(c2ccccc2)C(F)(F)F)CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSK P43235 13/20 0.48
KMT2A Q03164 1/20 0.34
CTSL P07711 2/20 0.34
CTSS P25774 2/20 0.34
CTSB P07858 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MMP1 P03956 1/20 0.33
CNR2 P34972 1/20 0.32

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
SCHEMBL13624171 0.84 CTSK (0.47) CTSKCTSLCTSSCTSBALDH1A1
SCHEMBL4367383 0.77 CTSK (0.51) CTSKKMT2AALDH1A1MAPT
SCHEMBL13624325 0.76 CTSK (0.49) CTSKKMT2ACTSLALDH1A1MAPT
SCHEMBL4368196 0.71 CTSK (0.42) CTSKCTSLCTSSCTSBALDH1A1
SCHEMBL2156068 0.70 CTSK (0.66) CTSKCTSLCTSSCTSB
SCHEMBL13624184 0.70 CTSL (0.42) CTSKCTSLCTSSCTSBALDH1A1
SCHEMBL13624280 0.70 CTSB (0.40) CTSKCTSLCTSSCTSB
SCHEMBL13624389 0.67 CTSK (0.50) CTSKKMT2ACTSLALDH1A1MAPT
SCHEMBL13624278 0.66 CTSB (0.57) CTSKCTSLCTSSCTSB
SCHEMBL13624309 0.66 CTSL (0.58) CTSKCTSLCTSSCTSB

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 CTSK 15/4885KMT2A 3986/4885CTSL 24/4885

“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.