SCHEMBL5468290

SCHEMBL5468290

O=C1O[C@@H](Cn2ccnn2)CN1c1ccc(C2=CC3C(COO)C3C2)c(F)c1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.61
CYP2D6 P10635 1/20 0.61
MAOA P21397 16/20 0.60
MAOB P27338 1/20 0.57
CYP2C9 P11712 1/20 0.52
KCNH2 Q12809 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
SCHEMBL5453269 0.91 CYP3A4 (0.63) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL5460223 0.87 MAOA (0.49) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL5461284 0.86 MAOA (0.62) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL5454936 0.85 MAOA (0.54) CYP3A4CYP2D6MAOAMAOBKCNH2
SCHEMBL5462815 0.85 MAOA (0.62) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL3328493 0.82 CYP3A4 (0.79) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL3328495 0.82 CYP3A4 (0.79) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL3328501 0.82 CYP3A4 (0.79) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL5461288 0.78 MAOA (0.53) CYP3A4CYP2D6MAOAMAOBCYP2C9
SCHEMBL5238263 0.77 MAOA (0.72) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070293493-A1 OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-12-20 US claimed
US-20070293493-A1 OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-12-20 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 (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-20070293493-A1 OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF OXA1L, RORC, IL17A CYP3A4 154/4885CYP2D6 91/4885MAOA 3244/4885

“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.