SCHEMBL4696277

SCHEMBL4696277

O=c1c(=O)c2ccccc2oc2ccccc12

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.90
KDM4E B2RXH2 4/20 0.90
ALDH1A1 P00352 3/20 0.90
CYP3A4 P08684 2/20 0.90
GLA P06280 1/20 0.90
MAPT P10636 1/20 0.90
HPGD P15428 1/20 0.90
PGAM1 P18669 1/20 0.90
CASP1 P29466 1/20 0.90
CASP7 P55210 1/20 0.90
SMN1; SMN2 Q16637 1/20 0.90
HSD17B10 Q99714 1/20 0.90
GAA P10253 2/20 0.58
NPC1 O15118 2/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
TTR P02766 2/20 0.55
MGAM O43451 1/20 0.55
SI P14410 1/20 0.55
MGAM2 Q2M2H8 1/20 0.55

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
Xanthone SCHEMBL41161 0.94 MAOA (1.00) MAOAKDM4EALDH1A1CYP3A4GLA
Xanthone SCHEMBL29398266 0.94 MAOA (1.00) MAOAKDM4EALDH1A1CYP3A4GLA
Xanthone SCHEMBL29358061 0.94 MAOA (1.00) MAOAKDM4EALDH1A1CYP3A4GLA
Xanthone SCHEMBL2354794 0.94 MAOA (1.00) MAOAKDM4EALDH1A1CYP3A4GLA
Xanthone SCHEMBL11399893 0.92 MAOA (0.95) MAOAKDM4EALDH1A1CYP3A4GLA
Xanthone SCHEMBL31110616 0.92 MAOA (0.95) MAOAKDM4EALDH1A1CYP3A4GLA
Xanthone SCHEMBL5376736 0.92 MAOA (0.95) MAOAKDM4EALDH1A1CYP3A4GLA
Xanthone SCHEMBL29060570 0.92 MAOA (0.95) MAOAKDM4EALDH1A1CYP3A4GLA
Xanthone SCHEMBL18556112 0.92 MAOA (0.95) MAOAKDM4EALDH1A1CYP3A4GLA
Xanthone SCHEMBL4560050 0.92 MAOA (0.95) MAOAKDM4EALDH1A1CYP3A4GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1509528-B1 1,3-DIAZA-DIBENZOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PREPARATION THEREOF GLAXOSMITHKLINE ZAGREB (HR) 2008-09-24 EP disclosed
US-7232815-B2 1-oxa-3-aza-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the production thereof GLAXOSMITHKLINE (HR) 2007-06-19 US disclosed
US-7166583-B2 1,3-diaza-dibenzoazulenes as inhibitors of tumour necrosis factor production and intermediates for the preparation thereof PLIVA-ISTRAZIVACKI INSTITUT D.O.O. (HR) 2007-01-23 US disclosed
EP-1492797-B1 1-OXA-3-AZA-DIBENZOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PRODUCTION THEREOF PLIVA ISTRAZIVACKI INST D O O (HR) 2006-03-15 EP disclosed
US-20050227963-A1 1,3-diaza-dibenzoazulenes as inhibitors of tumour necrosis factor production and intermediates for the preparation thereof GLAXOSMITHKLINE ISTRAZIVACKI CENTAR ZAGREB D.O.O. (HR) 2005-10-13 US disclosed
US-20050148576-A1 1-Oxa-3-aza-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the production thereof PLIVA-ISTRAZIVACKI INSTITUT D.O.O. (HR) 2005-07-07 US disclosed
US-20050130956-A1 1-oxa 3-aza-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the production thereof PLIVA-ISTRAZIVACKI INSTITUT D.O.O. (HR) 2005-06-16 US disclosed
EP-0146360-A2 Optically anisotropic melt forming copolyesters E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-06-26 EP 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 (3 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-20050148576-A1 1-Oxa-3-aza-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the production thereof TNF, IL1A, IL1B MAOA 1373/4885KDM4E 1436/4885ALDH1A1 42/4885
US-20050130956-A1 1-oxa 3-aza-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the production thereof TNF, IL1A, IL1B MAOA 1231/4885KDM4E 1411/4885ALDH1A1 34/4885
US-20050227963-A1 1,3-diaza-dibenzoazulenes as inhibitors of tumour necrosis factor production and intermediates for the preparation thereof IL1A, TNF, IL1B MAOA 2143/4885KDM4E 2573/4885ALDH1A1 45/4885

“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.