SCHEMBL4923970

SCHEMBL4923970

O=C1OC(Cn2ccnn2)CN1c1ccc(-c2cccnc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.75
CYP2D6 P10635 1/20 0.75
MAOA P21397 17/20 0.56
MAOB P27338 1/20 0.54
CYP2C9 P11712 1/20 0.51

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
SCHEMBL3327984 0.87 MAOA (0.65) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL4899222 0.86 CYP3A4 (1.00) CYP3A4CYP2D6MAOACYP2C9
SCHEMBL4929112 0.84 CYP3A4 (0.69) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL3325038 0.81 MAOA (0.60) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL5515504 0.81 MAOA (0.56) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL3328025 0.80 MAOA (0.55) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL14436450 0.80 MAOA (0.55) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL5522189 0.80 MAOA (0.55) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL3326296 0.79 MAOA (0.56) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL5519710 0.78 MAOA (0.53) CYP3A4CYP2D6MAOAMAOBCYP2C9

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
US-20080064689-A1 3-[4-(6-Pyridin-3-Yl)-3-Phenyl] -5-(1H-1,2,3-Triazol-1-Ylmethyl)-1,3-Oxazolidin-2-Ones as Antibacterial Agents ASTRAZENECA AB (SE) 2008-03-13 US disclosed
US-20080021071-A1 3-{4-(Pyridin-3-Yl) Phenyl}-5-(1H-1,2,3-Triazol-1-Ylmethyl)-1,3-Oxazolidin-2-Ones as Antibacterial Agents ASTRAZENECA AB (SE) 2008-01-24 US disclosed
CN-1989134-A 3- {4- (pyridin-3-yl) phenyl} -5- (1h-1, 2, 3-triazol-1-ylmethyl) -1, 3-oxazolidin-2-ones as antibacterial agents ASTRAZENECA AB (SE) 2007-06-27 CN disclosed
EP-1753755-A1 3- {4- (PYRIDIN-3-YL) PHENYL} -5- (1H-1, 2, 3-TRIAZOL-1-YLMETHYL) -1, 3-OXAZOLIDIN-2-ONES AS ANTIBACTERIAL AGENTS AstraZeneca AB (SE) 2007-02-21 EP 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-20080064689-A1 3-[4-(6-Pyridin-3-Yl)-3-Phenyl] -5-(1H-1,2,3-Triazol-1-Ylmethyl)-1,3-Oxazolidin-2-Ones as Antibacterial Agents H1-3, H1-0, MRPL21 CYP3A4 420/4885CYP2D6 155/4885MAOA 2336/4885
US-20080021071-A1 3-{4-(Pyridin-3-Yl) Phenyl}-5-(1H-1,2,3-Triazol-1-Ylmethyl)-1,3-Oxazolidin-2-Ones as Antibacterial Agents MRPL21, ARG1, OXA1L CYP3A4 69/4885CYP2D6 97/4885MAOA 936/4885

“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.