SCHEMBL1552825

SCHEMBL1552825

COc1cc(C=CC=C(C#N)C(=O)OCc2ccccc2)ccc1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.63
CA12 O43570 2/20 0.62
CA4 P22748 2/20 0.62
CA6 P23280 2/20 0.62
CA5A P35218 2/20 0.62
CA7 P43166 2/20 0.62
CA9 Q16790 2/20 0.62
CA14 Q9ULX7 2/20 0.62
CA5B Q9Y2D0 2/20 0.62
MAPT P10636 2/20 0.56
MEN1 O00255 1/20 0.56
ALDH1A1 P00352 1/20 0.56
KMT2A Q03164 1/20 0.56
TTR P02766 1/20 0.52
GSK3B P49841 1/20 0.49
BACE1 P56817 1/20 0.49
ALOX5 P09917 1/20 0.49
APP P05067 1/20 0.49
JUN P05412 1/20 0.48
NFKB1 P19838 1/20 0.48

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
SCHEMBL1552823 1.00 MAOB (0.63) MAOBCA12CA4CA6CA5A
SCHEMBL1551528 0.90 MAOB (0.60) MAOBCA12CA4CA6CA5A
SCHEMBL1551530 0.90 MAOB (0.60) MAOBCA12CA4CA6CA5A
SCHEMBL1552561 0.88 MAOB (0.69) MAOBMAPTMEN1ALDH1A1KMT2A
SCHEMBL1552227 0.88 MAOB (0.69) MAOBMAPTMEN1ALDH1A1KMT2A
SCHEMBL13678116 0.84 ALDH1A1 (0.59) MAOBCA12CA4CA6CA5A
SCHEMBL4477433 0.83 MAOB (0.77) MAOBMAPTMEN1ALDH1A1KMT2A
SCHEMBL4477440 0.83 MAOB (0.77) MAOBMAPTMEN1ALDH1A1KMT2A
SCHEMBL13678109 0.82 ALDH1A1 (0.56) MAOBCA12CA4CA6CA5A
SCHEMBL13678101 0.81 MAOB (0.78) MAOBMAPTMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7563820-B2 Compounds for modulating cell proliferation THE HOSPITAL FOR SICK CHILDREN (CA) 2009-07-21 US claimed
US-20070197660-A1 Compounds for modulating cell proliferation THE HOSPITAL FOR SICK CHILDREN (CA) 2007-08-23 US claimed
EP-1654220-A4 COMPOUNDS FOR MODULATING CELL PROLIFERATION HOSPITAL FOR SICK CHILDREN (CA) 2006-10-25 EP claimed
EP-1654220-A1 COMPOUNDS FOR MODULATING CELL PROLIFERATION The Hospital for Sick Children (CA) 2006-05-10 EP claimed
WO-2005012234-A1 COMPOUNDS FOR MODULATING CELL PROLIFERATION THE HOSPITAL FOR SICK CHILDREN (CA) 2005-02-10 WO claimed
EP-1467967-A1 COMPOUNDS FOR MODULATING CELL PROLIFERATION The Hospital for Sick Children (CA) 2004-10-20 EP claimed
WO-2003062190-A1 COMPOUNDS FOR MODULATING CELL PROLIFERATION THE HOSPITAL FOR SICK CHILDREN (CA) 2003-07-31 WO claimed
EP-1467967-B1 COMPOUNDS FOR MODULATING CELL PROLIFERATION HOSPITAL FOR SICK CHILDREN (CA) 2011-04-27 EP disclosed
US-7563820-B2 Compounds for modulating cell proliferation THE HOSPITAL FOR SICK CHILDREN (CA) 2009-07-21 US disclosed
US-20070197660-A1 Compounds for modulating cell proliferation THE HOSPITAL FOR SICK CHILDREN (CA) 2007-08-23 US disclosed
US-20060241084-A1 Inhibition of vascular endothelial growth factor THE HOSPITAL FOR SICK CHILDREN (CA) 2006-10-26 US disclosed
EP-1654220-A4 COMPOUNDS FOR MODULATING CELL PROLIFERATION HOSPITAL FOR SICK CHILDREN (CA) 2006-10-25 EP disclosed
EP-1654220-A1 COMPOUNDS FOR MODULATING CELL PROLIFERATION The Hospital for Sick Children (CA) 2006-05-10 EP disclosed
EP-1551381-A2 STYRYLACRYLONITRILE COMPOUNDS FOR INHIBITION OF VASCULAR ENDOTHELIAL GROWTH FACTOR The Hospital for Sick Children (CA) 2005-07-13 EP disclosed
US-20050085538-A1 Compounds for modulating cell proliferation HOSPITAL FOR SICK CHILDREN, THE (CA) 2005-04-21 US disclosed
WO-2005012234-A1 COMPOUNDS FOR MODULATING CELL PROLIFERATION THE HOSPITAL FOR SICK CHILDREN (CA) 2005-02-10 WO disclosed
EP-1467967-A1 COMPOUNDS FOR MODULATING CELL PROLIFERATION The Hospital for Sick Children (CA) 2004-10-20 EP disclosed
WO-2004032911-A2 STYRYLACRYLONITRILE COMPOUNDS FOR INHIBITION OF VASCULAR ENDOTHELIAL GROWTH FACTOR THE HOSPITAL FOR SICK CHILDREN (CA) 2004-04-22 WO disclosed
WO-2003062190-A1 COMPOUNDS FOR MODULATING CELL PROLIFERATION THE HOSPITAL FOR SICK CHILDREN (CA) 2003-07-31 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 (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-20060241084-A1 Inhibition of vascular endothelial growth factor VEGFA, FLT4, FLT1 MAOB 495/4885CA12 1078/4885CA4 443/4885
US-20050085538-A1 Compounds for modulating cell proliferation CCNO, CCNY, CCND3 MAOB 1268/4885CA12 3311/4885CA4 2060/4885
US-20070197660-A1 Compounds for modulating cell proliferation CCND3, CCNO, WNT3 MAOB 2008/4885CA12 2365/4885CA4 1081/4885

“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.