SCHEMBL12795145

SCHEMBL12795145

C=CC(=O)OCC(COC(=O)C=C)(COC(=O)CCN(C)CCCOc1ccc2sc3ccccc3c(=O)c2c1)COC(=O)CCN(C)CCCOc1ccc2sc3ccccc3c(=O)c2c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 11/20 0.43
MAOB P27338 11/20 0.43
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LTA4H P09960 7/20 0.40
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36

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
SCHEMBL12795168 0.89 MAOA (0.49) MAOAMAOBKDM4ENPC1ALDH1A1
SCHEMBL26779027 0.84 KDM4E (0.46) MAOAMAOBKDM4ENPC1ALDH1A1
SCHEMBL12748168 0.84 MAOA (0.50) MAOAMAOBKDM4ENPC1ALDH1A1
SCHEMBL12748082 0.84 MAOA (0.50) MAOAMAOBKDM4ENPC1ALDH1A1
SCHEMBL26779063 0.82 KDM4E (0.43) MAOAMAOBKDM4ENPC1ALDH1A1
SCHEMBL12795344 0.80 MAOA (0.50) MAOAMAOBKDM4ENPC1ALDH1A1
SCHEMBL13579134 0.80 MAOA (0.51) MAOAMAOBKDM4ENPC1ALDH1A1
SCHEMBL11994244 0.80 KDM4E (0.51) MAOAMAOBKDM4ENPC1ALDH1A1
SCHEMBL26779081 0.79 KDM4E (0.43) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL12795166 0.79 MAOA (0.50) MAOAMAOBKDM4ENPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10442940-B2 Radiation curable compositions for food packaging AGFA NV (BE) 2019-10-15 US disclosed
US-10316204-B2 Radiation curable compositions for food packaging AGFA NV (BE) 2019-06-11 US disclosed
US-9550898-B2 Radiation curable compositions for food packaging AGFA GRAPHICS NV (BE) 2017-01-24 US disclosed
US-9550898-B2 Radiation curable compositions for food packaging AGFA GRAPHICS NV (BE) 2017-01-24 US disclosed
US-20160208117-A1 RADIATION CURABLE COMPOSITIONS FOR FOOD PACKAGING AGFA GRAPHICS NV (BE) 2016-07-21 US disclosed
US-20160208117-A1 RADIATION CURABLE COMPOSITIONS FOR FOOD PACKAGING AGFA GRAPHICS NV (BE) 2016-07-21 US disclosed
US-20160200923-A1 RADIATION CURABLE COMPOSITIONS FOR FOOD PACKAGING AGFA NV (BE) 2016-07-14 US disclosed
US-20160200923-A1 RADIATION CURABLE COMPOSITIONS FOR FOOD PACKAGING AGFA NV (BE) 2016-07-14 US disclosed
US-20160200924-A1 RADIATION CURABLE COMPOSITIONS FOR FOOD PACKAGING AGFA NV (BE) 2016-07-14 US disclosed
US-20160200924-A1 RADIATION CURABLE COMPOSITIONS FOR FOOD PACKAGING AGFA NV (BE) 2016-07-14 US disclosed
US-8389769-B2 Polymerizable type II photoinitiators and curable compositions AGFA GRAPHICS NV (BE) 2013-03-05 US disclosed
US-8389769-B2 Polymerizable type II photoinitiators and curable compositions AGFA GRAPHICS NV (BE) 2013-03-05 US disclosed
US-20110063388-A1 POLYMERIZABLE TYPE II PHOTOINITIATORS AND CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2011-03-17 US disclosed
US-20110063388-A1 POLYMERIZABLE TYPE II PHOTOINITIATORS AND CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2011-03-17 US 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-20110063388-A1 POLYMERIZABLE TYPE II PHOTOINITIATORS AND CURABLE COMPOSITIONS CCNH, CRKL, ERH MAOA 2208/4885MAOB 2396/4885KDM4E 1945/4885

“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.