SCHEMBL455372

SCHEMBL455372

CC(C)(C)OC(=O)N1CC(=O)CC1c1cc(F)cc(C#N)c1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.39
RIPK1 Q13546 3/20 0.35
GPR119 Q8TDV5 8/20 0.35
EPAS1 Q99814 2/20 0.34
GRM5 P41594 1/20 0.33
MGLL Q99685 1/20 0.33

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
SCHEMBL12477574 1.00 AR (0.39) ARRIPK1GPR119EPAS1GRM5
SCHEMBL17067861 0.83 RIPK1 (0.46) RIPK1GPR119
SCHEMBL469821 0.83 RIPK1 (0.46) RIPK1GPR119
SCHEMBL445752 0.81 AR (0.40) ARRIPK1GPR119EPAS1
SCHEMBL12688003 0.81 AR (0.40) ARRIPK1GPR119EPAS1
SCHEMBL445864 0.81 AR (0.40) ARRIPK1GPR119EPAS1
SCHEMBL457104 0.81 AR (0.40) ARRIPK1GPR119EPAS1
SCHEMBL430865 0.81 AR (0.40) ARRIPK1GPR119EPAS1
SCHEMBL431625 0.81 AR (0.40) ARRIPK1GPR119EPAS1
SCHEMBL445865 0.81 AR (0.40) ARRIPK1GPR119EPAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2678338-B1 PYRAZOLO[1,5-A]PYRIDINES AS TRK INHIBITORS NOVARTIS AG (CH) 2015-09-09 EP disclosed
US-9102671-B2 Compounds and compositions as TRK inhibitors NOVARTIS AG (CH) 2015-08-11 US disclosed
EP-2678338-A1 COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS IRM LLC (BM) 2014-01-01 EP disclosed
US-20130331397-A1 COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS IRM LLC (BM) 2013-12-12 US disclosed
WO-2012116217-A1 COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS IRM LLC (BM) 2012-08-30 WO disclosed
WO-2012116217-A1 COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS IRM LLC (BM) 2012-08-30 WO disclosed
WO-2012034095-A1 COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS IRM LLC (BM) 2012-03-15 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 (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-20130331397-A1 COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS CNKSR1, BMP2K, RAF1 AR 495/4885RIPK1 239/4885GPR119 673/4885

“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.