SCHEMBL4218604

SCHEMBL4218604

CCCCCCCC(CC(=O)O)n1cc(O)c2c(Cl)c(Br)ccc21

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.35
MMP9 P14780 2/20 0.35
MMP12 P39900 2/20 0.35
GPR84 Q9NQS5 4/20 0.35
OXER1 Q8TDS5 11/20 0.34
S1PR2 O95136 1/20 0.33
S1PR1 P21453 1/20 0.33

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
SCHEMBL3216046 1.00 MMP2 (0.35) MMP2MMP9MMP12GPR84OXER1
SCHEMBL6570150 1.00 MMP2 (0.35) MMP2MMP9MMP12GPR84OXER1
SCHEMBL433816 1.00 MMP2 (0.35) MMP2MMP9MMP12GPR84OXER1
SCHEMBL432406 0.99 MMP2 (0.34) MMP2MMP9MMP12GPR84OXER1
SCHEMBL434728 0.79 MCL1 (0.39)
SCHEMBL4204689 0.79 GPR84 (0.35) MMP2MMP9MMP12GPR84OXER1
SCHEMBL4214092 0.79 GPR84 (0.35) MMP2MMP9MMP12GPR84OXER1
SCHEMBL432625 0.79 GPR84 (0.35) MMP2MMP9MMP12GPR84OXER1
SCHEMBL3269501 0.78 OXER1 (0.47) GPR84OXER1
SCHEMBL15846668 0.78 OXER1 (0.47) GPR84OXER1

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-8420345-B2 Method for identifying at least two groups of microorganisms BIOMERIEUX (FR) 2013-04-16 US disclosed
US-20090017481-A1 Method For Identifying at Least Two Groups of Microorganisms BIOMERIEUX (FR) 2009-01-15 US disclosed