SCHEMBL3294651

SCHEMBL3294651

O=[C]C(=O)[N]N1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA9 Q16790 1/20 0.35
MAPT P10636 4/20 0.35
KMT2A Q03164 2/20 0.35
RAB9A P51151 2/20 0.35
LMNA P02545 1/20 0.35
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
TSHR P16473 2/20 0.34
CYP1A1 P04798 1/20 0.34
HSD17B10 Q99714 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MMP1 P03956 1/20 0.33
MMP3 P08254 1/20 0.33
MMP8 P22894 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
ALOX15 P16050 1/20 0.32
NPC1 O15118 1/20 0.32

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
SCHEMBL3292882 0.74 CA2 (0.35) CA12CA1CA9
SCHEMBL4160204 0.73 KDM4E (0.45) SMN1; SMN2CA12CA1CA9MAPT
SCHEMBL5274851 0.73 SMN1; SMN2 (0.48) SMN1; SMN2CA12CA1CA9MAPT
SCHEMBL9526148 0.72
SCHEMBL951889 0.68 TSHR (0.46) SMN1; SMN2MAPTKMT2ARAB9ALMNA
SCHEMBL1455628 0.65 TSHR (0.56) SMN1; SMN2MAPTKMT2ARAB9ALMNA
SCHEMBL1896874 0.65 SMN1; SMN2 (0.50) SMN1; SMN2CA12CA1CA9MAPT
SCHEMBL7976882 0.64 HTT (0.55) SMN1; SMN2MAPTKMT2ARAB9ALMNA
N-Nitrosomorpholine SCHEMBL26048320 0.63
N-Nitrosomorpholine SCHEMBL1578515 0.63

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-20080187978-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2008-08-07 US claimed
US-20080064688-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2008-03-13 US claimed
US-20070191336-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-08-16 US claimed
EP-1773784-A2 ANTI-INFLAMMATORY MEDICAMENTS Deciphera Pharmaceuticals, LLC (US) 2007-04-18 EP claimed
WO-2006014290-A2 ANTI-INFLAMMATORY MEDICAMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2006-02-09 WO claimed
US-20050288286-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2005-12-29 US claimed
US-7737283-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2010-06-15 US disclosed
US-7531566-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2009-05-12 US disclosed
US-20090105230-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2009-04-23 US disclosed
US-20090075986-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2009-03-19 US disclosed
US-20080187978-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2008-08-07 US disclosed
US-20080132506-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2008-06-05 US disclosed
US-20080064688-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2008-03-13 US disclosed
US-7342037-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2008-03-11 US disclosed
US-20070191336-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-08-16 US disclosed
EP-1773784-A2 ANTI-INFLAMMATORY MEDICAMENTS Deciphera Pharmaceuticals, LLC (US) 2007-04-18 EP disclosed
US-7202257-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-04-10 US disclosed
WO-2006014290-A2 ANTI-INFLAMMATORY MEDICAMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2006-02-09 WO disclosed
US-20050288286-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2005-12-29 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 (6 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-20080064688-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF SMN1; SMN2 3576/4885CA12 2354/4885CA1 1588/4885
US-20090105230-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF SMN1; SMN2 3576/4885CA12 2354/4885CA1 1588/4885
US-20090075986-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF SMN1; SMN2 3576/4885CA12 2354/4885CA1 1588/4885
US-20050288286-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF SMN1; SMN2 3576/4885CA12 2354/4885CA1 1588/4885
US-20070191336-A1 p38 kinase inhibitors MAPK1, MAP3K8, MAP3K1 SMN1; SMN2 1101/4885CA12 4553/4885CA1 2613/4885
US-20080132506-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF SMN1; SMN2 3576/4885CA12 2354/4885CA1 1588/4885

“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.