SCHEMBL4574440

SCHEMBL4574440

O=C1c2ccccc2C(=O)N1C[C@H]1CN(c2ccc(Br)c(F)c2)C(=O)O1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 6/20 0.47
CYP3A4 P08684 3/20 0.45
CYP2D6 P10635 2/20 0.45
MAOA P21397 8/20 0.43
MAOB P27338 1/20 0.43
CYP2C9 P11712 2/20 0.42
ALDH1A1 P00352 1/20 0.42
GRM2 Q14416 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL16701317 0.90 CALML3 (0.49) CALML3CYP3A4CYP2D6MAOAMAOB
SCHEMBL16701320 0.90 CALML3 (0.49) CALML3CYP3A4CYP2D6MAOAMAOB
SCHEMBL1036062 0.87 CALML3 (0.47) CALML3CYP3A4CYP2D6MAOAMAOB
SCHEMBL13151038 0.87 CALML3 (0.47) CALML3CYP3A4CYP2D6MAOAMAOB
SCHEMBL1034941 0.87 CALML3 (0.47) CALML3CYP3A4CYP2D6MAOAMAOB
SCHEMBL7537758 0.85 CALML3 (0.45) CALML3CYP3A4CYP2D6MAOAMAOB
SCHEMBL7537751 0.85 CALML3 (0.45) CALML3CYP3A4CYP2D6MAOAMAOB
SCHEMBL7544447 0.84 CALML3 (0.45) CALML3CYP3A4CYP2D6MAOAMAOB
SCHEMBL7537986 0.84 CALML3 (0.44) CALML3CYP3A4CYP2D6MAOAMAOB
SCHEMBL9823246 0.83 ALDH1A1 (0.53) CYP3A4CYP2D6CYP2C9ALDH1A1GRM2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219941-A1 OXAZOLIDINONE COMPOUNDS, LIPOSOME COMPOSITIONS COMPRISING OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AKAGERA MEDICINES, INC. (US) 2023-07-13 US disclosed
US-20230219941-A1 OXAZOLIDINONE COMPOUNDS, LIPOSOME COMPOSITIONS COMPRISING OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AKAGERA MEDICINES, INC. (US) 2023-07-13 US disclosed
US-20230126415-A1 OXAZOLIDINONE COMPOUNDS, LIPOSOME COMPOSITIONS COMPRISING OXAZOLIDINONE COMPOUNDS AND METHOD OF USE THEREOF AKAGERA MEDICINES, INC. (US) 2023-04-27 US disclosed
US-20230126415-A1 OXAZOLIDINONE COMPOUNDS, LIPOSOME COMPOSITIONS COMPRISING OXAZOLIDINONE COMPOUNDS AND METHOD OF USE THEREOF AKAGERA MEDICINES, INC. (US) 2023-04-27 US disclosed
WO-2008069619-A1 NOVEL OXAZOLIDINONE DERIVATIVES, PROCESS FOR PREPARING THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LEGOCHEM BIOSCIENCE LTD. (KR) 2008-06-12 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-20230126415-A1 OXAZOLIDINONE COMPOUNDS, LIPOSOME COMPOSITIONS COMPRISING OXAZOLIDINONE COMPOUNDS AND METHOD OF USE THEREOF OXA1L, THPO, TBCD CALML3 2409/4885CYP3A4 773/4885CYP2D6 329/4885
US-20230219941-A1 OXAZOLIDINONE COMPOUNDS, LIPOSOME COMPOSITIONS COMPRISING OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF OXA1L, THPO, TBCD CALML3 2394/4885CYP3A4 833/4885CYP2D6 382/4885

“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.