SCHEMBL3549595

SCHEMBL3549595

CCCCCCN1Cc2ccc(O)cc2OC1=O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.46
DRD2 P14416 1/20 0.39
DRD1 P21728 1/20 0.39
DRD4 P21917 1/20 0.39
DRD5 P21918 1/20 0.39
DRD3 P35462 1/20 0.39
OPRM1 P35372 11/20 0.38
OPRD1 P41143 11/20 0.38
OPRK1 P41145 11/20 0.38
SIGMAR1 Q99720 10/20 0.38
GRM2 Q14416 2/20 0.38

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
SCHEMBL28620084 0.76 MIF (0.54) MIFDRD2DRD1DRD4DRD5
SCHEMBL2767117 0.74 MIF (0.44) MIFDRD2DRD1DRD4DRD5
SCHEMBL21158528 0.71 GBA1 (0.41)
SCHEMBL20869858 0.71 GBA1 (0.41)
SCHEMBL2935731 0.69 DRD2 (0.41) DRD2DRD1DRD4DRD5DRD3
SCHEMBL11344678 0.69 ALDH1A1 (0.40)
SCHEMBL2499130 0.69 GRM5 (0.46)
SCHEMBL2765998 0.68 MIF (0.70) MIF
SCHEMBL28582810 0.68 DRD2 (0.39) DRD2DRD1DRD4DRD5DRD3
SCHEMBL31166754 0.67 MIF (0.39) MIFGRM2

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 2538/4885DRD2 299/4885DRD1 563/4885

“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.