SCHEMBL5234841

SCHEMBL5234841

O=C1O[C@@H](CO)CN1c1cc(F)c(C2=CCSCC2)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 6/20 0.48
MAOA P21397 7/20 0.44
MAOB P27338 4/20 0.44
CYP2C19 P33261 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP3A4 P08684 1/20 0.38
F10 P00742 2/20 0.37

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
SCHEMBL5232769 0.86 CALML3 (0.61) CALML3MAOAMAOBCYP2C19CYP2C9
SCHEMBL6365509 0.86 CALML3 (0.61) CALML3MAOAMAOBCYP2C19CYP2C9
SCHEMBL5230590 0.85 MAOA (0.42) CALML3MAOAMAOBCYP3A4
SCHEMBL7691878 0.85 MAOA (0.60) CALML3MAOAMAOBF10
SCHEMBL7691880 0.85 MAOA (0.60) CALML3MAOAMAOBF10
SCHEMBL3042359 0.83 MAOA (0.53) CALML3MAOAMAOBF10
SCHEMBL6396969 0.82 MAOA (0.47) CALML3MAOAMAOBCYP2C19CYP2C9
SCHEMBL6396961 0.82 MAOA (0.47) CALML3MAOAMAOBCYP2C19CYP2C9
SCHEMBL5742018 0.81 MAOA (0.56) MAOAMAOBCYP3A4
SCHEMBL5229080 0.81 MAOA (0.56) MAOAMAOBCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1286998-B2 OXAZOLIDINONE DERIVATIVES WITH ANTIBIOTIC ACTIVITY ASTRAZENECA AB (SE) 2007-10-31 EP disclosed
US-7141583-B2 Oxazolidinone derivatives with antibiotic activity ASTRAZENECA AB (SE) 2006-11-28 US disclosed
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-1286998-B1 OXAZOLIDINONE DERIVATIVES WITH ANTIBIOTIC ACTIVITY ASTRAZENECA AB (SE) 2004-06-09 EP disclosed
US-20030216373-A1 Oxazolidinone derivatives with antibiotic activity ASTRAZENECA AB (SE) 2003-11-20 US disclosed
WO-2002081469-A1 OXAZOLIDINONE-SULFOXIMINES AND -SULFILIMINES 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 (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-20050032861-A1 Oxazolidines containing a sulfonimid group as antibiotics SULT1E1, STS, OXA1L CALML3 3934/4885MAOA 963/4885MAOB 357/4885
US-20030216373-A1 Oxazolidinone derivatives with antibiotic activity STS, SULT1E1, OXA1L CALML3 4326/4885MAOA 2239/4885MAOB 2032/4885

“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.