SCHEMBL5742018

SCHEMBL5742018

O=C1OC(Cn2ccnn2)CN1c1cc(F)c(C2=CCSCC2)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOA P21397 17/20 0.56
MAOB P27338 1/20 0.55
CYP3A4 P08684 3/20 0.53
CYP2D6 P10635 1/20 0.53
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
SCHEMBL5229080 1.00 MAOA (0.56) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL5238263 0.89 MAOA (0.72) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL5230590 0.86 MAOA (0.42) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL5233903 0.84 MAOA (0.56) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL5232210 0.83 MAOA (0.80) MAOAMAOBCYP3A4CYP2D6KCNH2
Hydrochloric Acid SCHEMBL5233940 0.83 MAOA (0.57) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL5234584 0.82 MAOA (0.56) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL5742132 0.82 MAOA (0.68) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL5743011 0.82 MAOA (0.68) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL5742127 0.82 MAOA (0.68) MAOAMAOBCYP3A4CYP2D6KCNH2

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
EP-1385844-B1 OXAZOLIDINONES CONTAINING A SULFONIMID GROUP AS ANTIBIOTICS ASTRAZENECA AB (SE) 2006-07-05 EP disclosed
US-20050032861-A1 Oxazolidines containing a sulfonimid group as antibiotics ASTRAZENECA AB (SE) 2005-02-10 US disclosed
EP-1385844-A1 OXAZOLIDINONES CONTAINING A SULFONIMID GROUP AS ANTIBIOTICS Astrazeneca AB (SE) 2004-02-04 EP disclosed
WO-2002081470-A1 OXAZOLIDINONES CONTAINING A SULFONIMID GROUP AS ANTIBIOTICS ASTRAZENECA AB (SE) 2002-10-17 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-20050032861-A1 Oxazolidines containing a sulfonimid group as antibiotics SULT1E1, STS, OXA1L MAOA 963/4885MAOB 357/4885CYP3A4 46/4885

“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.