SCHEMBL5555644

SCHEMBL5555644

CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](CC(C)C)C(=O)NNC(=O)C1CCNCC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.48
CTSL P07711 3/20 0.48
CTSS P25774 3/20 0.48
CTSB P07858 2/20 0.48
GAA P10253 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CAPN1 P07384 1/20 0.43
MAPK1 P28482 1/20 0.43
REN P00797 2/20 0.43
MAP1LC3B Q9GZQ8 1/20 0.43
MAP1LC3A Q9H492 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
AAK1 Q2M2I8 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
SCHEMBL5557583 0.98 CTSK (0.50) CTSKCTSLCTSSCTSBGAA
SCHEMBL16316463 0.87 CTSS (0.50) CTSKCTSLCTSSCTSBGAA
SCHEMBL5551719 0.82 CTSK (0.48) CTSKCTSLCTSSCTSBGAA
SCHEMBL5555584 0.81 CTSK (0.58) CTSKCTSSKMT2ARENAAK1
SCHEMBL5556499 0.79 CTSS (0.56) CTSKCTSLCTSSCTSBMEN1
SCHEMBL7513684 0.76 CTSK (0.51) CTSKCTSLCTSSCTSBGAA
SCHEMBL25286879 0.75 CTSK (0.66) CTSKCTSLCTSSCTSBGAA
SCHEMBL27350811 0.74 CTSL (0.68) CTSKCTSLCTSSCTSBGAA
SCHEMBL7392267 0.74 CTSL (0.68) CTSKCTSLCTSSCTSBGAA
SCHEMBL4576781 0.74 CTSL (0.68) CTSKCTSLCTSSCTSBGAA

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-20070014721-A1 Hydrazide conjugates as imaging agents LANTHEUS MEDICAL IMAGING, INC. 2007-01-18 US disclosed
US-20070014721-A1 Hydrazide conjugates as imaging agents LANTHEUS MEDICAL IMAGING, INC. 2007-01-18 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-20070014721-A1 Hydrazide conjugates as imaging agents CA14, CA13, CA1 CTSK 1070/4885CTSL 2354/4885CTSS 1532/4885

“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.