SCHEMBL1811481

SCHEMBL1811481

CC(C)(C)OC(=O)C(C(=O)OC(C)(C)C)c1cncc(Cl)n1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
KMT2A Q03164 1/20 0.57
TRPA1 O75762 1/20 0.33
STK17B O94768 1/20 0.33
STK17A Q9UEE5 1/20 0.33
ATR Q13535 1/20 0.33
MAPKAPK2 P49137 3/20 0.32
CDK2 P24941 1/20 0.32
P2RY2 P41231 1/20 0.31
CTSA P10619 1/20 0.31
APP P05067 1/20 0.31
S1PR3 Q99500 1/20 0.30
RAB9A P51151 1/20 0.30
NPR3 P17342 1/20 0.30

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
SCHEMBL21392096 0.94 LMNA (0.52) LMNAKMT2ATRPA1STK17BSTK17A
SCHEMBL27287525 0.86 KMT2A (0.46) LMNAKMT2ATRPA1STK17BSTK17A
SCHEMBL12216750 0.85 LMNA (0.44) LMNAKMT2ATRPA1STK17BSTK17A
SCHEMBL8218226 0.85 LMNA (0.44) LMNAKMT2ATRPA1STK17BSTK17A
SCHEMBL30556962 0.82 MAPK1 (0.39) LMNAKMT2ACDK2CTSAS1PR3
SCHEMBL26122997 0.82 MAPK1 (0.39) LMNAKMT2ACDK2CTSAS1PR3
SCHEMBL2580431 0.79 ALDH1A1 (0.38) LMNAKMT2ACTSARAB9A
SCHEMBL21392123 0.76 TRPA1 (0.40) LMNAKMT2ATRPA1STK17BSTK17A
SCHEMBL30415301 0.76 TRPA1 (0.40) LMNAKMT2ATRPA1STK17BSTK17A
SCHEMBL21381606 0.75 MAPK1 (0.37) LMNAKMT2ACDK2CTSAS1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1801108-B9 MORPHOLINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATIONS MITSUBISHI TANABE PHARMA CORP (JP) 2013-11-20 EP disclosed
EP-1801108-B1 MORPHOLINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATIONS MITSUBISHI TANABE PHARMA CORP (JP) 2012-11-14 EP disclosed
US-7935700-B2 Morpholine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-05-03 US disclosed
US-20070265257-A1 Morpholine Compound MITSUBISHI PHARMA CORPORATION (JP) 2007-11-15 US disclosed
EP-1801108-A1 MORPHOLINE COMPOUND Mitsubishi Pharma Corporation (JP) 2007-06-27 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 (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-20070265257-A1 Morpholine Compound CCR3, CCR1, CCR4 LMNA 2526/4885KMT2A 1652/4885TRPA1 137/4885

“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.