SCHEMBL541639

SCHEMBL541639

CC(C)(C)[SiH2]OC(C)(C)[C@H]1CN(c2ccc(OCC3CCN(C(=O)OCc4ccccc4)C3)c(F)c2)C(=O)O1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
RBP4 P02753 2/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
CHRM4 P08173 3/20 0.35
CYP2C19 P33261 1/20 0.35
GRIN2B Q13224 3/20 0.35
HTT P42858 1/20 0.35
FAAH O00519 1/20 0.35
CHRM2 P08172 2/20 0.35
CHRM5 P08912 2/20 0.35
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34

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
SCHEMBL541638 0.84 PDE4B (0.40) PDE4BPTGDR2RBP4SMN1; SMN2CHRM4
SCHEMBL541589 0.84 S1PR5 (0.41)
SCHEMBL541400 0.84 CALML3 (0.47) PDE4BPTGDR2SMN1; SMN2NPC1RAB9A
SCHEMBL541401 0.84 CALML3 (0.47) PDE4BPTGDR2SMN1; SMN2NPC1RAB9A
SCHEMBL584240 0.74 STAT3 (0.33) CHRM2CHRM1
SCHEMBL3813623 0.71 CALML3 (0.46) SMN1; SMN2CYP2C19
SCHEMBL541126 0.70 CALML3 (0.47) SMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL541127 0.70 CALML3 (0.47) SMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL17769268 0.70 GRM2 (0.47)
SCHEMBL17769267 0.70 GRM2 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124623-B2 5-hydroxymethyl-oxazolidin-2-one-derivatives and their uses as antibacterials ACTELION PHARMACEUTICALS LTD. (CH) 2012-02-28 US disclosed
EP-2086968-B1 5-HYDROXYMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2012-02-08 EP disclosed
US-20090247578-A1 5-HYDROXYMETHYL-OXAZOLIDIN-2-ONE-DERIVATIVES AND THEIR USES AS ANTIBACTERIALS ACTELION PHARMACEUTICALS LTD. (CH) 2009-10-01 US disclosed
EP-2086968-A1 5-HYDROXYMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2009-08-12 EP disclosed
WO-2008056335-A1 5-HYDROXYMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2008-05-15 WO 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-20090247578-A1 5-HYDROXYMETHYL-OXAZOLIDIN-2-ONE-DERIVATIVES AND THEIR USES AS ANTIBACTERIALS OGFOD1, OXGR1, ODC1 PDE4B 3900/4885PTGDR2 3327/4885RBP4 1798/4885

“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.