SCHEMBL6765396

SCHEMBL6765396

O=C1O[C@@H](CO)CN1c1cc(F)c(C2=CCOCC2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 7/20 0.49
MAOB P27338 7/20 0.45
MAOA P21397 6/20 0.45
CYP2C19 P33261 2/20 0.41
CYP2C9 P11712 1/20 0.41
LMNA P02545 1/20 0.40
PTGS1 P23219 1/20 0.40
SDHA P31040 1/20 0.40
CYP3A4 P08684 1/20 0.39

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
SCHEMBL5236431 0.86 CALML3 (0.62) CALML3MAOBMAOACYP2C19CYP2C9
SCHEMBL6395266 0.86 CALML3 (0.62) CALML3MAOBMAOACYP2C19CYP2C9
SCHEMBL7025191 0.85 MAOA (0.59) CALML3MAOBMAOALMNAPTGS1
SCHEMBL6398888 0.81 MAOA (0.48) CALML3MAOBMAOA
SCHEMBL6398883 0.81 MAOA (0.48) CALML3MAOBMAOA
SCHEMBL5234841 0.81 CALML3 (0.48) CALML3MAOBMAOACYP2C19CYP2C9
SCHEMBL7078321 0.81 MAOA (0.48) CALML3MAOBMAOACYP2C19CYP2C9
SCHEMBL4013083 0.81 MAOA (0.58) CALML3MAOBMAOA
SCHEMBL5656454 0.81 CALML3 (0.47) CALML3MAOBMAOA
SCHEMBL412867 0.76 CALML3 (0.62) CALML3MAOBMAOACYP2C19CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6734200-B1 ANTIBIOTIC COMPOUNDS CONTAINING A SUBSTITUTED OXAZOLIDINONE RING; ACTIVITY AGAINST GRAM-POSITIVE PATHOGENS ASTRAZENECA AB (SE) 2004-05-11 US disclosed
US-20030207899-A1 Heterocyclylaminomethyloxazo-lidinones as antibacterials ASTRAZENECA AB (SE) 2003-11-06 US disclosed
US-6638955-B2 Antibiotic oxazolidinone derivatives SYNGENTA LIMITED (GB) 2003-10-28 US disclosed
US-20020133022-A1 Antibiotic oxazolidinone derivatives SYNGENTA LIMITED (GB) 2002-09-19 US disclosed
US-6365751-B1 ACTIVE AGAINST GRAM-POSITIVE BACTERIA, IN PARTICULAR, AGAINST STRAINS RESISTANT TO VANCOMYCIN, AMINOGLYCOSIDES AND PENCILLINS AND DERIVATIVES; NONTOXIC ZENECA LTD. (GB) 2002-04-02 US disclosed
EP-1121358-A1 HETEROCYCLYLAMINOMETHYLOXAZOLIDINONES AS ANTIBACTERIALS AstraZeneca AB (SE) 2001-08-08 EP disclosed
US-6271383-B1 USEFUL ACTIVITY AGAINST GRAM-POSITIVE PATHOGENS; IN PARTICULAR, AGAINST VARIOUS STRAINS EXHIBITING RESISTANCE TO VANCOMYCIN AND AGAINST E. FAECIUM STRAINS RESISTANT TO BOTH AMINOGLYCOSIDES AND CLINICALLY USED BETA-LACTAMS. ZENECA LIMITED (GB) 2001-08-07 US disclosed
WO-2000021960-A1 HETEROCYCLYL AMINO METHYLOXA ZOLIDINONES AS ANTIBACTERIALS ASTRAZENECA AB (SE) 2000-04-20 WO disclosed
US-5981528-A Antibiotic oxazolidinone derivatives ZENECA LIMITED 1999-11-09 US 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-20020133022-A1 Antibiotic oxazolidinone derivatives OXA1L, POLN, MRPL21 CALML3 4763/4885MAOB 2698/4885MAOA 2791/4885
US-20030207899-A1 Heterocyclylaminomethyloxazo-lidinones as antibacterials HDHD5, CYP8B1, LSS CALML3 4410/4885MAOB 705/4885MAOA 652/4885

“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.