SCHEMBL3196867

SCHEMBL3196867

CC(C)(C)[Si](C)(C)OCC1CN(c2ccc(C(CO)Cn3cc([N+](=O)[O-])nc3Br)c(F)c2)C(=O)O1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 4/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
MAOA P21397 10/20 0.35
MAOB P27338 2/20 0.35
GRM2 Q14416 2/20 0.33

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
SCHEMBL13484675 1.00 CALML3 (0.36) CALML3CYP3A4CYP2C19MAOAMAOB
SCHEMBL3205904 0.89 MAOA (0.34) CALML3CYP3A4CYP2C19MAOAMAOB
SCHEMBL13484674 0.89 MAOA (0.34) CALML3CYP3A4CYP2C19MAOAMAOB
SCHEMBL3208462 0.85 MAOA (0.48) CALML3MAOAMAOB
SCHEMBL15686426 0.85 MAOA (0.48) CALML3MAOAMAOB
SCHEMBL3196871 0.85 CYP3A4 (0.31) CALML3CYP3A4CYP2C19MAOA
SCHEMBL3196860 0.83 MAOA (0.31) CALML3CYP3A4CYP2C19MAOA
SCHEMBL15642851 0.81 CALML3 (0.36) CALML3CYP3A4CYP2C19MAOAMAOB
SCHEMBL13484676 0.75 CHRM1 (0.38) CALML3MAOAMAOBGRM2
SCHEMBL3206561 0.75 CHRM1 (0.38) CALML3MAOAMAOBGRM2

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-A1 BICYCLIC NITROIMIDAZOLES COVALENTLY LINKED TO SUBSTITUTED PHENYL OXAZOLIDINONES Global Alliance For Tb Drug Development (US) 2010-12-01 EP disclosed
US-7666864-B2 Bicyclic nitroimidazole-substituted phenyl oxazolidinones GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT (US) 2010-02-23 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 2605/4885CYP3A4 564/4885CYP2C19 461/4885

“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.