SCHEMBL2845713

SCHEMBL2845713

O=C1O[C@@H](CNC(=O)C(F)(F)F)CN1c1ccc(OCc2ccccc2)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 10/20 0.48
▸ MAOB P27338 5/20 0.47
▸ MAOA P21397 4/20 0.47
▸ LMNA P02545 1/20 0.47
▸ PTGS1 P23219 1/20 0.47
▸ CALML3 P27482 1/20 0.47
▸ SDHA P31040 1/20 0.47
▸ S1PR5 Q9H228 1/20 0.44

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
SCHEMBL2845717 1.00 F10 (0.48) F10MAOBMAOALMNAPTGS1
SCHEMBL541807 0.84 CALML3 (0.59) MAOBMAOACALML3S1PR5
SCHEMBL541806 0.84 CALML3 (0.59) MAOBMAOACALML3S1PR5
SCHEMBL2837784 0.82 GRM2 (0.47) F10CALML3S1PR5
SCHEMBL9611100 0.82 GRM2 (0.49) CALML3S1PR5
SCHEMBL17769261 0.82 GRM2 (0.47) CALML3S1PR5
SCHEMBL17769259 0.82 GRM2 (0.47) CALML3S1PR5
SCHEMBL2838615 0.81 F10 (0.56) F10MAOBMAOALMNAPTGS1
SCHEMBL2838621 0.81 F10 (0.56) F10MAOBMAOALMNAPTGS1
SCHEMBL17769268 0.81 GRM2 (0.47) MAOBMAOALMNAPTGS1CALML3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2256120-A1 Oxazolidinone-quinolone hybrids as antibacterial compounds Actelion Pharmaceuticals Ltd. (CH) 2010-12-01 — — EP disclosed
US-20100222302-A1 Novel Antibacterial Compounds ACTELION PHARMACEUTICALS LTD (CH) 2010-09-02 — — US disclosed
EP-1931684-A2 OXAZOLIDINONE-QUINOLONE HYBRIDS AS ANTIBACTERIAL COMPOUNDS Actelion Pharmaceuticals Ltd. (CH) 2008-06-18 — — EP disclosed
WO-2007017828-A2 OXAZOLIDINONE-QUINOLONE HYBRIDS AS ANTIBACTERIAL COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2007-02-15 — — 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-20100222302-A1 Novel Antibacterial Compounds ODC1, AOC1, OGFOD1 F10 3355/4885MAOB 1605/4885MAOA 1464/4885

“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.

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