SCHEMBL5845905

SCHEMBL5845905

CN(C(=O)O)[C@@H]1CN(c2ccc(C3CSC3)c(F)c2)C(=O)O1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.48
MAOB P27338 5/20 0.39
CALML3 P27482 5/20 0.36
LMNA P02545 1/20 0.36
PTGS1 P23219 1/20 0.36
SDHA P31040 1/20 0.36
F10 P00742 4/20 0.35
FADS1 O60427 1/20 0.35
TSHR P16473 1/20 0.34
GRM2 Q14416 1/20 0.34

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
SCHEMBL5378623 0.92 MAOA (0.44) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL5725958 0.90 MAOA (0.52) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL5730354 0.87 MAOA (0.48) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL5394057 0.83 MAOA (0.37) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL4884934 0.82 MAOA (0.43) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL6249325 0.82 MAOA (0.48) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL6335209 0.81 MAOA (0.40) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL4884103 0.81 MAOA (0.46) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL6767666 0.81 MAOB (0.40) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL5727398 0.78 MAOA (0.56) MAOAMAOBCALML3LMNAPTGS1

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-6998420-B2 Oxazolidinone compounds PHARMACIA & UPJOHN COMPANY (US) 2006-02-14 US disclosed
US-6833453-B2 As an example, manufacturing a 5-(tert-butylcarbamoyl)-amino-methyl-oxazolidinone by condensing a carbamate with a tert-butylcarbamoyl protected derivative of glycidylamine or a 3-amino-1-halopropanol PHARMACIA & UPJOHN COMPANY 2004-12-21 US disclosed
US-20040143131-A1 in particular,manufacturing a 5-(tert-butylcarbamoyl)-aminomethyl-oxazolidinone by condensing a carbamate with a tert-butylcarbamoyl protected derivative of glycidylamine or 3-amino-1-halopropanol, intermediates PHARMACIA & UPJOHN COMPANY 2004-07-22 US disclosed
EP-1328509-A1 METHODS OF PRODUCING OXAZOLIDINONE COMPOUNDS Pharmacia & Upjohn Company (US) 2003-07-23 EP disclosed
US-20020086900-A1 Methods of producing oxazolidinone compounds PERRAULT WILLIAM R (US) 2002-07-04 US disclosed
WO-2002032857-A1 METHODS OF PRODUCING OXAZOLIDINONE COMPOUNDS PHARMACIA & UPJOHN COMPANY (US) 2002-04-25 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 (2 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-20040143131-A1 in particular,manufacturing a 5-(tert-butylcarbamoyl)-aminomethyl-oxazolidinone by condensing a carbamate with a tert-butylcarbamoyl protected derivative of glycidylamine or 3-amino-1-halopropanol, intermediates TET1, NAT10, TET3 MAOA 3886/4885MAOB 3604/4885CALML3 2643/4885
US-20020086900-A1 Methods of producing oxazolidinone compounds TET3, TET1, AZI2 MAOA 3150/4885MAOB 2453/4885CALML3 2487/4885

“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.