SCHEMBL4013233

SCHEMBL4013233

Cc1cn(-c2ccc(N3C[C@H](CN)OC3=O)cc2F)cn1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 9/20 0.46
MAOB P27338 8/20 0.46
CALML3 P27482 3/20 0.46
LMNA P02545 1/20 0.46
PTGS1 P23219 1/20 0.46
SDHA P31040 1/20 0.46
F10 P00742 1/20 0.43
KCNH2 Q12809 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
SCHEMBL5235589 0.90 CALML3 (0.56) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL5834576 0.90 CALML3 (0.56) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL13939823 0.88 MAOB (0.44) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL7831540 0.85 MAOA (0.67) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL4015253 0.85 MAOA (0.64) MAOAMAOBKCNH2
SCHEMBL4018839 0.85 MAOB (0.48) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL7831535 0.85 MAOA (0.67) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL5657145 0.85 MAOB (0.48) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL13939865 0.85 MAOA (0.42) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL5235407 0.84 MAOA (0.52) MAOAMAOBKCNH2

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-7473699-B2 3-cyclyl-5-(nitrogen-containing 5-membered ring)methyl-oxazolidinone derivatives and their use as antibacterial agents ASTRAZENECA AB (SE) 2009-01-06 US disclosed
US-7473699-B2 3-cyclyl-5-(nitrogen-containing 5-membered ring)methyl-oxazolidinone derivatives and their use as antibacterial agents ASTRAZENECA AB (SE) 2009-01-06 US disclosed
US-7473699-B2 3-cyclyl-5-(nitrogen-containing 5-membered ring)methyl-oxazolidinone derivatives and their use as antibacterial agents ASTRAZENECA AB (SE) 2009-01-06 US disclosed
US-20050119292-A1 3-Cyclyl-5-(nitrogen-containing 5-membered ring)methyl-oxazolidinone derivatives and their use as antibacterial agents ASTRAZENECA AB (SE) 2005-06-02 US disclosed
EP-1497286-A1 3-CYCLYL-5-(NITROGEN-CONTAINING 5-MEMBERED RING) METHYL-OXAZOLIDINONE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS Astrazeneca AB (SE) 2005-01-19 EP disclosed
WO-2003072575-A1 3-CYCLYL-5-(NITROGEN-CONTAINING 5-MEMBERED RING) METHYL-OXAZOLIDINONE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS ASTRAZENECA AB (SE) 2003-09-04 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-20050119292-A1 3-Cyclyl-5-(nitrogen-containing 5-membered ring)methyl-oxazolidinone derivatives and their use as antibacterial agents H1-0, NGLY1, H1-5 MAOA 1576/4885MAOB 992/4885CALML3 3848/4885

“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.