SCHEMBL4848148

SCHEMBL4848148

CC(C)(C)OC(=O)NCCNC(=O)[C@H](CCCNC(=O)[C@H](CCCN)N(C(=O)OCc1ccccc1)C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPB1 P15086 1/20 0.49
CPB2 Q96IY4 1/20 0.49
SIRT2 Q8IXJ6 2/20 0.47
SIRT1 Q96EB6 2/20 0.47
SIRT3 Q9NTG7 2/20 0.47
TPSAB1 Q15661 2/20 0.47
TPSD1 Q9BZJ3 2/20 0.47
TPSG1 Q9NRR2 2/20 0.47
CTSS P25774 3/20 0.47
CTSK P43235 2/20 0.47
KLK7 P49862 2/20 0.46
KLK5 Q9Y337 2/20 0.46
MAPT P10636 2/20 0.45
MMP1 P03956 1/20 0.43
MMP3 P08254 1/20 0.43
MMP9 P14780 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CTSL P07711 1/20 0.42
POLB P06746 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
SCHEMBL4848153 0.87 TPSAB1 (0.47) CPB1CPB2SIRT2SIRT1SIRT3
SCHEMBL4852318 0.84 CPB1 (0.47) CPB1CPB2SIRT2SIRT1SIRT3
SCHEMBL23626336 0.84 CPB1 (0.67) CPB1CPB2SIRT2SIRT1SIRT3
SCHEMBL4853178 0.83 TPSAB1 (0.47) CPB1CPB2SIRT2SIRT1SIRT3
SCHEMBL4857149 0.83 MAPT (0.58) CPB1CPB2SIRT2SIRT1SIRT3
SCHEMBL4857153 0.83 SIRT2 (0.47) CPB1CPB2SIRT2SIRT1SIRT3
SCHEMBL28477062 0.83 TPSAB1 (0.46) TPSAB1TPSD1TPSG1CTSK
SCHEMBL28477064 0.83 TPSAB1 (0.46) TPSAB1TPSD1TPSG1CTSK
SCHEMBL7448992 0.82 TPSAB1 (0.49) CPB1CPB2SIRT2SIRT1SIRT3
SCHEMBL1023512 0.82 CPB1 (0.47) CPB1CPB2SIRT2SIRT1SIRT3

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-7446102-B2 Antibacterial amide macrocycles IV AICURIS GMBH & CO. KG (DE) 2008-11-04 US disclosed
US-20080076745-A1 ANTIBACTERIAL AMIDE MACROCYCLES IV AICURIS GMBH & CO. KG (DE) 2008-03-27 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-20080076745-A1 ANTIBACTERIAL AMIDE MACROCYCLES IV NOD2, AAAS, AADAC CPB1 2819/4885CPB2 2025/4885SIRT2 115/4885

“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.