SCHEMBL5492060

SCHEMBL5492060

CC(C)(C)[C@H](NC(=O)C(CC1CCCC1)CN(O)C=O)C(=O)N1CCCN(C(=O)OCc2ccccc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 8/20 0.44
MMP13 P45452 4/20 0.44
HTT P42858 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
MMP2 P08253 4/20 0.38
MMP3 P08254 2/20 0.38
USP19 O94966 1/20 0.38

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
SCHEMBL5492062 1.00 MMP1 (0.44) MMP1MMP13HTTNPC1RAB9A
SCHEMBL5496205 0.98 MMP1 (0.45) MMP1MMP13HTTNPC1RAB9A
SCHEMBL5496209 0.98 MMP1 (0.45) MMP1MMP13HTTNPC1RAB9A
SCHEMBL5495841 0.87 MMP1 (0.42) MMP1MMP13SMN1; SMN2MMP2MMP3
SCHEMBL5495839 0.87 MMP1 (0.42) MMP1MMP13SMN1; SMN2MMP2MMP3
SCHEMBL6135720 0.86 MMP1 (0.48) MMP1MMP13MMP2MMP3
SCHEMBL6135717 0.86 MMP1 (0.48) MMP1MMP13MMP2MMP3
SCHEMBL6135506 0.86 MMP1 (0.48) MMP1MMP13MMP2MMP3
SCHEMBL6135501 0.86 MMP1 (0.48) MMP1MMP13MMP2MMP3
SCHEMBL5497357 0.85 MMP2 (0.44) MMP2MMP3

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-20070129310-A1 Antibacterial agents VERNALIS (OXFORD) LTD. (GB) 2007-06-07 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-20070129310-A1 Antibacterial agents ARG1, SCO2, SPOUT1 MMP1 3562/4885MMP13 3787/4885HTT 3358/4885

“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.