SCHEMBL13616294

SCHEMBL13616294

O=C1O[C@@H](CO)CN1c1cc(F)c(-c2ccc(O[C@@H]3COc4nc([N+](=O)[O-])cn4C3)nc2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 6/20 0.41
CYP2C19 P33261 2/20 0.40
CYP2C9 P11712 1/20 0.40
CHRM1 P11229 1/20 0.40
MAOA P21397 9/20 0.40
MAOB P27338 2/20 0.40
CYP3A4 P08684 1/20 0.38

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
SCHEMBL3195213 1.00 CALML3 (0.41) CALML3CYP2C19CYP2C9CHRM1MAOA
SCHEMBL13484627 0.92 CALML3 (0.51) CALML3CYP2C19CYP2C9MAOAMAOB
SCHEMBL3195694 0.92 CALML3 (0.51) CALML3CYP2C19CYP2C9MAOAMAOB
SCHEMBL3195686 0.92 CALML3 (0.51) CALML3CYP2C19CYP2C9MAOAMAOB
SCHEMBL3195699 0.92 CALML3 (0.51) CALML3CYP2C19CYP2C9MAOAMAOB
SCHEMBL3212160 0.92 MAOA (0.42) CALML3CHRM1MAOAMAOB
SCHEMBL13484650 0.92 MAOA (0.42) CALML3CHRM1MAOAMAOB
SCHEMBL13484655 0.87 CHRM1 (0.40) CALML3CYP2C19CYP2C9CHRM1MAOA
SCHEMBL3196907 0.87 CHRM1 (0.40) CALML3CYP2C19CYP2C9CHRM1MAOA
SCHEMBL13484652 0.85 CHRM1 (0.46) CALML3CYP2C19CYP2C9CHRM1MAOA

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
EP-2254892-B1 BICYCLIC NITROIMIDAZOLES COVALENTLY LINKED TO SUBSTITUTED PHENYL OXAZOLIDINONES GLOBAL ALLIANCE FOR TB DRUG DEV (US) 2014-04-23 EP disclosed
US-20090281088-A1 BICYCLIC NITROIMIDAZOLE-SUBSTITUTED PHENYL OXAZOLIDINONES GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT (US) 2009-11-12 US disclosed
US-20090281088-A1 BICYCLIC NITROIMIDAZOLE-SUBSTITUTED PHENYL OXAZOLIDINONES GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT (US) 2009-11-12 US disclosed
WO-2009120789-A1 BICYCLIC NITROIMIDAZOLES COVALENTLY LINKED TO SUBSTITUTED PHENYL OXAZOLIDINONES GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT (US) 2009-10-01 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-20090281088-A1 BICYCLIC NITROIMIDAZOLE-SUBSTITUTED PHENYL OXAZOLIDINONES O60361, OXA1L, TBCD CALML3 2605/4885CYP2C19 461/4885CYP2C9 613/4885

“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.