SCHEMBL4635104

SCHEMBL4635104

CC(C)C[C@H](CC(=O)NOC1CCCCO1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.41
MMP3 P08254 7/20 0.36
MMP1 P03956 5/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
MMP14 P50281 1/20 0.36
SLC1A3 P43003 1/20 0.35
SLC1A2 P43004 1/20 0.35
LTA4H P09960 1/20 0.33
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
CCNA1 P78396 1/20 0.32
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32
EPHX2 P34913 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL4633172 0.89 MME (0.42) MMEMMP3MMP1MMP2MMP9
SCHEMBL4633169 0.89 MME (0.42) MMEMMP3MMP1MMP2MMP9
SCHEMBL4635116 0.82 MME (0.40) MMEMMP3MMP1MMP2MMP9
SCHEMBL23911882 0.78 CCNA2 (0.35) CCNA2CDK2CCNA1CDK5CDK5R1
SCHEMBL7385209 0.76 CCNA2 (0.34) CCNA2CDK2CCNA1CDK5CDK5R1
SCHEMBL4633117 0.76 MMP2 (0.62) MMP3MMP1MMP2MMP9MMP14
SCHEMBL4634154 0.76 MMP2 (0.62) MMP3MMP1MMP2MMP9MMP14
SCHEMBL30940157 0.75 CCNA2 (0.38) CCNA2CDK2CCNA1CDK5CDK5R1
SCHEMBL22108760 0.75 LAP3 (0.34) MMESLC1A3SLC1A2MEN1KMT2A
SCHEMBL7383746 0.74 MEN1 (0.35) MMP1MMP2MMP9MMP14LTA4H

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-1931624-A1 USE OF AN AUREOLYSIN INHIBITOR FOR THE TREATMENT OF INFLAMMATORY SKIN CONDITIONS CHARACTERISED BY COLONISATION WITH STAPHYLOCOCCUS AUREUS Serentis Limited (GB) 2008-06-18 EP disclosed
WO-2007025999-A1 USE OF AN AUREOLYSIN INHIBITOR FOR THE TREATMENT OF INFLAMMATORY SKIN CONDITIONS CHARACTERISED BY COLONISATION WITH STAPHYLOCOCCUS AUREUS SERENTIS LIMITED (GB) 2007-03-08 WO disclosed
US-20070049518-A1 Novel method of treatment of inflammatory skin conditions SERENTIS LIMITED (GB) 2007-03-01 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-20070049518-A1 Novel method of treatment of inflammatory skin conditions MMP8, CUTA, MMP1 MME 540/4885MMP3 13/4885MMP1 3/4885

“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.