SCHEMBL5454936

SCHEMBL5454936

CC(C)(C)[Si](OCC1C2C=C(c3ccc(N4C[C@H](Cn5ccnn5)OC4=O)cc3F)CC21)(c1ccccc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOA P21397 17/20 0.54
CYP3A4 P08684 2/20 0.53
CYP2D6 P10635 1/20 0.53
MAOB P27338 1/20 0.49
KCNH2 Q12809 1/20 0.45

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
SCHEMBL5461100 0.89 MAOA (0.44) MAOACYP3A4CYP2D6MAOBKCNH2
SCHEMBL5468290 0.85 CYP3A4 (0.61) MAOACYP3A4CYP2D6MAOBKCNH2
SCHEMBL6422776 0.85 MAOA (0.41) MAOACYP3A4CYP2D6MAOB
SCHEMBL6336919 0.85 MAOA (0.41) MAOACYP3A4CYP2D6MAOB
SCHEMBL6336922 0.85 MAOA (0.41) MAOACYP3A4CYP2D6MAOB
SCHEMBL6336924 0.85 MAOA (0.41) MAOACYP3A4CYP2D6MAOB
SCHEMBL6337007 0.84 MAOA (0.53) MAOAMAOB
SCHEMBL5453269 0.83 CYP3A4 (0.63) MAOACYP3A4CYP2D6MAOBKCNH2
SCHEMBL5461284 0.80 MAOA (0.62) MAOACYP3A4CYP2D6MAOBKCNH2
SCHEMBL5462815 0.78 MAOA (0.62) MAOACYP3A4CYP2D6MAOBKCNH2

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-20070293493-A1 OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-12-20 US claimed
EP-1646630-A1 OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF Merck & Co., Inc. (US) 2006-04-19 EP claimed
WO-2005005422-A1 OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF MERCK & CO., INC. (US) 2005-01-20 WO claimed
US-20070293493-A1 OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-12-20 US disclosed
EP-1646630-A1 OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF Merck & Co., Inc. (US) 2006-04-19 EP disclosed
WO-2005005422-A1 OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF MERCK & CO., INC. (US) 2005-01-20 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 (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 MAOA 3244/4885CYP3A4 154/4885CYP2D6 91/4885

“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.