SCHEMBL17837612

SCHEMBL17837612

CC(C)(C)OC(=O)N1CC=C(c2nc(C(N)=O)ccc2F)CC1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 11/20 0.53
GRM5 P41594 10/20 0.53
PDK4 Q16654 1/20 0.47
PDE10A Q9Y233 1/20 0.47
TNK2 Q07912 2/20 0.47
NAMPT P43490 1/20 0.45
GPR119 Q8TDV5 2/20 0.44
JAK1 P23458 1/20 0.44
ATR Q13535 1/20 0.44

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
SCHEMBL30513849 0.86 GRM1 (0.54) GRM1GRM5PDK4PDE10ATNK2
SCHEMBL25119907 0.86 GRM1 (0.54) GRM1GRM5PDK4PDE10ATNK2
SCHEMBL30849174 0.85 PDK4 (0.53) GRM1GRM5PDK4NAMPTGPR119
SCHEMBL17844398 0.83 TRPV1 (0.40) GRM1GRM5TNK2
SCHEMBL3791998 0.80 GRM5 (0.71) GRM1GRM5PDK4PDE10ATNK2
SCHEMBL17837639 0.80 GRM1 (0.57) GRM1GRM5PDK4PDE10ATNK2
SCHEMBL12537891 0.79 GRM1 (0.51) GRM1GRM5PDK4PDE10ATNK2
SCHEMBL29611764 0.78 GRM1 (0.53) GRM1GRM5PDK4PDE10ATNK2
SCHEMBL16434825 0.78 GRM1 (0.58) GRM1GRM5PDK4NAMPTGPR119
SCHEMBL12883596 0.76 PDK4 (0.53) GRM1GRM5PDK4TNK2NAMPT

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-3233829-B1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS PFIZER (US) 2019-08-14 EP disclosed
EP-3233829-B1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS PFIZER (US) 2019-08-14 EP disclosed
EP-3233829-A1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS Pfizer Inc (US) 2017-10-25 EP disclosed
US-9593097-B2 Axl inhibitors PFIZER INC. (US) 2017-03-14 US disclosed
US-9593097-B2 Axl inhibitors PFIZER INC. (US) 2017-03-14 US disclosed
WO-2016097918-A1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS PFIZER INC. (US) 2016-06-23 WO disclosed
US-20160176850-A1 AXL INHIBITORS PFIZER INC. 2016-06-23 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-20160176850-A1 AXL INHIBITORS AXL, FLT3, MERTK GRM1 1082/4885GRM5 1645/4885PDK4 2668/4885

“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.