SCHEMBL4013373

SCHEMBL4013373

NC[C@H]1CN(c2ccc(-n3ccnc3)c(F)c2)C(=O)O1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.50
MAOA P21397 6/20 0.50
CALML3 P27482 4/20 0.50
CYP3A4 P08684 2/20 0.46
CYP2C9 P11712 1/20 0.46
LMNA P02545 1/20 0.45
PTGS1 P23219 1/20 0.45
SDHA P31040 1/20 0.45
KCNH2 Q12809 2/20 0.45
F10 P00742 1/20 0.44
CYP2D6 P10635 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
SCHEMBL5832684 0.89 CALML3 (0.64) MAOBMAOACALML3CYP3A4CYP2C9
SCHEMBL8111357 0.89 CALML3 (0.64) MAOBMAOACALML3CYP3A4CYP2C9
SCHEMBL5832691 0.89 CALML3 (0.64) MAOBMAOACALML3CYP3A4CYP2C9
SCHEMBL14302608 0.88 MAOB (0.48) MAOBMAOACALML3LMNAPTGS1
SCHEMBL14574048 0.88 MAOB (0.48) MAOBMAOACALML3LMNAPTGS1
SCHEMBL14564164 0.87 MAOB (0.48) MAOBMAOACALML3CYP3A4CYP2C9
SCHEMBL14183166 0.87 MAOB (0.48) MAOBMAOACALML3CYP3A4CYP2C9
SCHEMBL5327031 0.85 MAOB (0.49) MAOBMAOACALML3LMNAPTGS1
SCHEMBL5327022 0.85 MAOB (0.49) MAOBMAOACALML3LMNAPTGS1
SCHEMBL3747475 0.84 CYP3A4 (0.45) MAOBMAOACALML3CYP3A4CYP2C9

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-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 MAOB 992/4885MAOA 1576/4885CALML3 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.