SCHEMBL2234815

SCHEMBL2234815

CCn1cnc2c(=O)n(-c3ccc(F)cc3)c(Oc3ccc(F)cc3F)nc21

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.42
MET P08581 6/20 0.39
AXL P30530 5/20 0.39
HTT P42858 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
MAPK14 Q16539 7/20 0.39
CDK1 P06493 2/20 0.38
NPBWR1 P48145 1/20 0.37
MCHR1 Q99705 1/20 0.37
MAPK8 P45983 1/20 0.37

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
SCHEMBL11920297 0.94 BRD4 (0.40) BRD4METAXLHTTNCOA3
SCHEMBL2235855 0.93 HTT (0.39) BRD4METAXLHTTNCOA3
SCHEMBL2235271 0.92 MAT2A (0.43) BRD4METAXLHTTNCOA3
SCHEMBL2233232 0.91 HTT (0.37) BRD4METAXLHTTNCOA3
SCHEMBL2235092 0.90 HTT (0.39) BRD4METHTTNCOA3CDK1
SCHEMBL2236085 0.89 HTT (0.39) METAXLHTTNCOA3CDK1
SCHEMBL2235223 0.88 NCOA3 (0.38) HTTNCOA3CDK1
SCHEMBL2233418 0.88 HTT (0.41) METAXLHTTNCOA3CDK1
SCHEMBL2234582 0.86 MAPK14 (0.43) BRD4METMAPK14NPBWR1MCHR1
SCHEMBL4256906 0.85 BRD4 (0.40) BRD4METAXLMAPK14NPBWR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759361-B2 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2014-06-24 US claimed
EP-2061794-B1 2-PHENOXY PYRIMIDINONE ANALOGUES NEUROGEN CORP (US) 2012-12-05 EP claimed
US-20120208829-A1 2-PHENOXY PYRIMIDINONE ANALOGUES NEUROGEN CORPORATION (US) 2012-08-16 US claimed
US-8003656-B2 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2011-08-23 US claimed
US-20090069347-A1 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2009-03-12 US claimed
US-8759361-B2 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2014-06-24 US disclosed
EP-2061794-B1 2-PHENOXY PYRIMIDINONE ANALOGUES NEUROGEN CORP (US) 2012-12-05 EP disclosed
US-20120208829-A1 2-PHENOXY PYRIMIDINONE ANALOGUES NEUROGEN CORPORATION (US) 2012-08-16 US disclosed
US-8003656-B2 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2011-08-23 US disclosed
US-20090069347-A1 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2009-03-12 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 (2 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-20120208829-A1 2-PHENOXY PYRIMIDINONE ANALOGUES GPR174, GPR17, PTGFR BRD4 2607/4885MET 560/4885AXL 661/4885
US-20090069347-A1 2-phenoxy pyrimidinone analogues GPR174, GPR17, PTGFR BRD4 2607/4885MET 560/4885AXL 661/4885

“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.