SCHEMBL1072867

SCHEMBL1072867

CC(C)(C)OC(=O)NCCC[C@H](CNC(=O)C[C@H](CCCNC(=O)OC(C)(C)C)N(Cc1ccccc1)C(=O)O)NC(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.47
ATM Q13315 1/20 0.44
MAPT P10636 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
GAA P10253 1/20 0.42
CTSK P43235 4/20 0.41
MMP1 P03956 1/20 0.41
MMP3 P08254 1/20 0.41
MMP9 P14780 1/20 0.41
SIRT5 Q9NXA8 1/20 0.41
CTSS P25774 2/20 0.40
IDO1 P14902 1/20 0.39
APP P05067 1/20 0.39
AKT1 P31749 2/20 0.39
KLK7 P49862 1/20 0.39
KLK5 Q9Y337 1/20 0.39

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
SCHEMBL4853602 1.00 SYK (0.47) SYKATMMAPTMEN1KMT2A
SCHEMBL1024008 0.89 KMT2A (0.48) SYKMAPTMEN1KMT2AGAA
SCHEMBL5066754 0.88 SYK (0.45) SYKATMMAPTMEN1KMT2A
SCHEMBL4850221 0.85 SYK (0.49) SYKATMMAPTMEN1KMT2A
SCHEMBL4850228 0.85 SYK (0.49) SYKATMMAPTMEN1KMT2A
SCHEMBL4848854 0.85 SYK (0.46) SYKATMMAPTMEN1KMT2A
SCHEMBL1023321 0.85 SYK (0.46) SYKATMMAPTMEN1KMT2A
SCHEMBL1024156 0.85 SYK (0.48) SYKATMMAPTMEN1KMT2A
SCHEMBL4852088 0.85 SYK (0.48) SYKATMMAPTMEN1KMT2A
SCHEMBL1023983 0.84 SYK (0.42) SYKATMMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1797110-B1 ANTIBACTERIAL AMIDE MACROCYCLES IV AICURIS GMBH & CO KG (DE) 2011-01-12 EP disclosed
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 SYK 3060/4885ATM 2832/4885MAPT 4356/4885

“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.