SCHEMBL3544246

SCHEMBL3544246

NS(=O)(=O)Oc1ccc2c(c1)OC(=O)N(c1ccc(O)cc1)C2

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MIF P14174 2/20 0.53
STS P08842 14/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
CA2 P00918 3/20 0.39
CA7 P43166 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HSD17B3 P37058 1/20 0.37
CA9 Q16790 2/20 0.34
CA1 P00915 1/20 0.34

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
SCHEMBL3551113 0.93 MIF (0.58) MIFSTSHDAC3HDAC1HDAC2
SCHEMBL3545608 0.93 MIF (0.46) MIFSTSCA2CA7CA9
SCHEMBL3543201 0.88 MIF (0.50) MIFSTSCA2CA7NPC1
SCHEMBL2766273 0.88 STS (0.43) MIFSTSCA2CA7CA9
SCHEMBL13166570 0.87 MIF (0.44) MIFSTSCA2CA7CA9
SCHEMBL3548006 0.86 MIF (0.50) MIFSTSCA2CA7NPC1
SCHEMBL3546808 0.86 CA2 (0.45) MIFSTSCA2CA7CA9
SCHEMBL3547917 0.83 MIF (0.67) MIFHDAC3HDAC1HDAC2CA2
SCHEMBL3543484 0.83 STS (0.40) MIFSTSCA2CA7CA9
SCHEMBL2766527 0.82 MIF (0.54) MIFHDAC3HDAC1HDAC2NPC1

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-7795251-B2 3,4-dihydro-benzo[e][1,3]oxazin-2-ones NOVARTIS AG (CH) 2010-09-14 US disclosed
US-20090156588-A1 3,4-DIHYDRO-BENZO[E][1,3]OXAZIN-2-ONES NOVARTIS AG (CH) 2009-06-18 US disclosed
EP-1874742-A1 3,4-DIHYDRO-BENZO[E][1,3]OXAZIN-2-ONES Novartis AG (CH) 2008-01-09 EP disclosed
WO-2006108671-A1 3,4-DIHYDRO-BENZO[E][1,3]OXAZIN-2-ONES NOVARTIS AG (CH) 2006-10-19 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-20090156588-A1 3,4-DIHYDRO-BENZO[E][1,3]OXAZIN-2-ONES CYP2C8, CYP2C18, CYP4B1 MIF 2538/4885STS 1186/4885HDAC3 166/4885

“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.