SCHEMBL4856502

SCHEMBL4856502

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

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.48
MMP1 P03956 1/20 0.45
MMP3 P08254 1/20 0.45
MMP9 P14780 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
GAA P10253 1/20 0.43
CTSS P25774 5/20 0.42
CTSK P43235 4/20 0.42
CTSL P07711 2/20 0.41
CTSB P07858 2/20 0.41
MAPT P10636 2/20 0.41
ATM Q13315 1/20 0.41
PAX8 Q06710 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
IDO1 P14902 1/20 0.40
AKT1 P31749 3/20 0.40
SIGMAR1 Q99720 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
SCHEMBL1024580 0.89 MMP1 (0.44) SYKMMP1MMP3MMP9MEN1
SCHEMBL1022382 0.89 MMP1 (0.43) SYKMMP1MMP3MMP9MEN1
SCHEMBL4850221 0.88 SYK (0.49) SYKMMP1MMP3MMP9MEN1
SCHEMBL4850228 0.88 SYK (0.49) SYKMMP1MMP3MMP9MEN1
SCHEMBL1020939 0.87 MEN1 (0.51) SYKMMP1MMP3MMP9MEN1
SCHEMBL1020978 0.86 MEN1 (0.46) SYKMMP1MMP3MMP9MEN1
SCHEMBL5066754 0.83 SYK (0.45) SYKMMP1MMP3MMP9MEN1
SCHEMBL1022884 0.82 CTSK (0.53) MMP1MMP3MMP9MEN1KMT2A
SCHEMBL1259156 0.81 MEN1 (0.50) SYKMMP1MMP3MMP9MEN1
SCHEMBL1021954 0.81 SYK (0.51) SYKMEN1KMT2AGAAMAPT

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 SYK 3060/4885MMP1 2538/4885MMP3 1892/4885

“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.