SCHEMBL10152687

SCHEMBL10152687

CC(C)(C)OC(=O)N1CCN(c2c(F)cc(N3C[C@H](COS(C)(=O)=O)OC3=O)cc2F)CCO1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.44
MAOB P27338 12/20 0.41
LMNA P02545 1/20 0.39
PTGS1 P23219 1/20 0.39
CALML3 P27482 1/20 0.39
SDHA P31040 1/20 0.39
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35
USP30 Q70CQ3 1/20 0.34
SCN9A Q15858 1/20 0.34
F10 P00742 2/20 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
SCHEMBL2499941 0.89 MAOA (0.43) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL2483101 0.89 MAOA (0.43) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL10153003 0.88 MAOA (0.51) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL10152689 0.88 MAOA (0.48) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL11975452 0.85 MAOA (0.43) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL10152686 0.84 MAOA (0.57) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL10152943 0.83 MAOA (0.42) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL13589325 0.83 MAOA (0.43) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL10152690 0.82 MAOB (0.47) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL18770290 0.82 MAOA (0.57) MAOAMAOBLMNAPTGS1CALML3

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
US-8530646-B2 Oxazolidinone derivative having 7-membered hetero ring RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2013-09-10 US disclosed
US-8148362-B2 Compound having heterocyclic ring RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2012-04-03 US disclosed
US-20100256355-A1 OXAZOLIDINONE DERIVATIVE HAVING 7-MEMBERED HETERO RING Research Foundation ITSUU Laboratory and Shionogi & Co., Ltd. 2010-10-07 US disclosed
US-20090299059-A1 Novel Compound Having Heterocyclic Ring RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2009-12-03 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 (2 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-20090299059-A1 Novel Compound Having Heterocyclic Ring NR0B2, NR2C2, NR0B1 MAOA 2965/4885MAOB 2611/4885LMNA 4493/4885
US-20100256355-A1 OXAZOLIDINONE DERIVATIVE HAVING 7-MEMBERED HETERO RING NR0B2, NR0B1, NR2C2 MAOA 2966/4885MAOB 2570/4885LMNA 4337/4885

“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.