SCHEMBL11969166

SCHEMBL11969166

C#CCN1CCN(c2ccc(N3C[C@H](CO)OC3=O)cc2F)C=N1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.57
CALML3 P27482 7/20 0.51
MAOB P27338 10/20 0.45
LMNA P02545 1/20 0.44
PTGS1 P23219 1/20 0.44
SDHA P31040 1/20 0.44
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
F10 P00742 1/20 0.42

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
SCHEMBL11969165 0.88 MAOA (0.61) MAOACALML3MAOBLMNAPTGS1
SCHEMBL13428676 0.88 MAOA (0.61) MAOACALML3MAOBLMNAPTGS1
SCHEMBL11968944 0.87 MAOA (0.76) MAOACALML3MAOBLMNAPTGS1
SCHEMBL13428804 0.87 MAOA (0.63) MAOACALML3MAOBLMNAPTGS1
SCHEMBL11969111 0.87 MAOA (0.63) MAOACALML3MAOBLMNAPTGS1
SCHEMBL11968976 0.86 MAOA (0.62) MAOACALML3MAOBLMNAPTGS1
SCHEMBL13428801 0.86 MAOA (0.62) MAOACALML3MAOBLMNAPTGS1
SCHEMBL13428762 0.85 MAOA (0.59) MAOACALML3MAOBLMNAPTGS1
SCHEMBL11969120 0.85 MAOA (0.61) MAOACALML3MAOBLMNAPTGS1
SCHEMBL13428709 0.85 MAOA (0.61) MAOACALML3MAOBLMNAPTGS1

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-8242113-B2 Oxazolidinone derivatives with cyclic amidoxime or cyclic amidrazone pharmaceutical compositions thereof LEGOCHEM BIOSCIENCES, INC. (KR) 2012-08-14 US disclosed
US-8242113-B2 Oxazolidinone derivatives with cyclic amidoxime or cyclic amidrazone pharmaceutical compositions thereof LEGOCHEM BIOSCIENCES, INC. (KR) 2012-08-14 US disclosed
US-20110178293-A1 Novel Oxazolidinone Derivatives with Cyclic Amidoxime or Cyclic Amidrazone and Pharmaceutical Compositions Thereof LEGOCHEM BIOSCIENCE LTD. (KR) 2011-07-21 US disclosed
US-20110178293-A1 Novel Oxazolidinone Derivatives with Cyclic Amidoxime or Cyclic Amidrazone and Pharmaceutical Compositions Thereof LEGOCHEM BIOSCIENCE LTD. (KR) 2011-07-21 US disclosed
WO-2010036000-A2 NOVEL OXAZOLIDINONE DERIVATIVES WITH CYCLIC AMIDOXIME OR CYCLIC AMIDRAZONE AND PHARMACEUTICAL COMPOSITIONS THEREOF LEGOCHEM BIOSCIENCE LTD. (KR) 2010-04-01 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-20110178293-A1 Novel Oxazolidinone Derivatives with Cyclic Amidoxime or Cyclic Amidrazone and Pharmaceutical Compositions Thereof PAM, PYCARD, PEPD MAOA 3476/4885CALML3 3502/4885MAOB 3050/4885

“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.