SCHEMBL13101223

SCHEMBL13101223

CNC(=S)NC[C@H]1CN(c2ccc(N3CCNN(C(=O)CO)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 7/20 0.56
▸ MAOA P21397 4/20 0.56
▸ PTGS1 P23219 2/20 0.56
▸ SDHA P31040 2/20 0.56
▸ LMNA P02545 1/20 0.56
▸ CALML3 P27482 1/20 0.56
▸ F10 P00742 11/20 0.56

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
SCHEMBL13101191 0.93 MAOB (0.61) MAOBMAOAPTGS1SDHALMNA
SCHEMBL10152703 0.91 MAOB (0.57) MAOBMAOAPTGS1SDHALMNA
SCHEMBL13101241 0.91 F10 (0.56) MAOBMAOAPTGS1SDHALMNA
SCHEMBL13174845 0.91 F10 (0.57) MAOBMAOAPTGS1SDHALMNA
SCHEMBL10151509 0.90 MAOB (0.69) MAOBMAOAPTGS1SDHALMNA
SCHEMBL10151510 0.90 F10 (0.61) MAOBMAOAPTGS1SDHALMNA
SCHEMBL13271876 0.89 F10 (0.59) MAOBMAOAPTGS1SDHALMNA
SCHEMBL7161407 0.89 F10 (0.69) MAOBMAOAPTGS1SDHALMNA
SCHEMBL7161413 0.89 F10 (0.69) MAOBMAOAPTGS1SDHALMNA
SCHEMBL10151586 0.87 F10 (0.59) MAOBMAOAPTGS1SDHALMNA

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 6 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-8530646-B2 Oxazolidinone derivative having 7-membered hetero ring RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2013-09-10 — — 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-20100256355-A1 OXAZOLIDINONE DERIVATIVE HAVING 7-MEMBERED HETERO RING Research Foundation ITSUU Laboratory and Shionogi & Co., Ltd. 2010-10-07 — — US disclosed
EP-2233484-A2 Oxazolidinone derivatives having a 7-membered heterocyclic ring Research Foundation Itsuu Laboratory (JP) 2010-09-29 — — EP disclosed
EP-2208729-A1 OXAZOLIDINONE DERIVATIVE HAVING 7-MEMBERED HETERO RING Research Foundation Itsuu Laboratory (JP) 2010-07-21 — — EP 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-20100256355-A1 OXAZOLIDINONE DERIVATIVE HAVING 7-MEMBERED HETERO RING NR0B2, NR0B1, NR2C2 MAOB 2570/4885MAOA 2966/4885PTGS1 4086/4885

“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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