SCHEMBL12065646

SCHEMBL12065646

CC(C)OC(c1ccc(OC(F)(F)F)cc1)c1nc2cccnc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 8/20 0.41
▸ NPY5R Q15761 1/20 0.38
▸ ENPP2 Q13822 5/20 0.38
▸ RIPK1 Q13546 1/20 0.37
▸ ATP1A1 P05023 1/20 0.37
▸ ATP1B1 P05026 1/20 0.37
▸ ATP1A3 P13637 1/20 0.37
▸ ATP1B2 P14415 1/20 0.37
▸ ATP1A2 P50993 1/20 0.37
▸ ATP1B3 P54709 1/20 0.37
▸ FXYD2 P54710 1/20 0.37
▸ ATP1A4 Q13733 1/20 0.37
▸ CBFB Q13951 1/20 0.36
▸ SCN10A Q9Y5Y9 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ RUNX1 Q01196 1/20 0.36

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
SCHEMBL14770695 0.86 CCNB2 (0.45) PDE2ARIPK1
SCHEMBL12065644 0.83 MLKL (0.52) PDE2ACBFBSCN10ARUNX1
SCHEMBL12065648 0.81 PDE10A (0.42) PDE2ANPY5RCBFBRUNX1
SCHEMBL12065643 0.76 SCN10A (0.46) PDE2ASCN10ATRPV1RUNX1
SCHEMBL14762782 0.76 SCN10A (0.43) PDE2ASCN10ATRPV1
SCHEMBL12065627 0.75 MEN1 (0.46) PDE2ASCN10A
SCHEMBL31661032 0.71 GRM4 (0.34) PDE2ARIPK1
SCHEMBL12065635 0.71 MLKL (0.68) CBFBSCN10ATRPV1RUNX1
SCHEMBL12066026 0.69 PDE2A (0.37) PDE2ASCN10A
SCHEMBL1106425 0.69 HSD17B10 (0.46) RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2578573-A1 FUSED IMIDAZOLE DERIVATIVE TOA Eiyo Ltd. (JP) 2013-04-10 — — EP claimed
US-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE TOA EIYO LTD. (JP) 2013-03-14 — — US claimed
US-9096531-B2 Fused imidazole derivative TOA EIYO LTD. (JP) 2015-08-04 — — US disclosed
EP-2578573-A1 FUSED IMIDAZOLE DERIVATIVE TOA Eiyo Ltd. (JP) 2013-04-10 — — EP disclosed
US-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE TOA EIYO LTD. (JP) 2013-03-14 — — US disclosed
WO-2011148956-A1 FUSED IMIDAZOLE DERIVATIVE トーアエイヨー株式会社 (JP) 2011-12-01 — — 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-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE CACNA1E, CACNA1G, CACNA1A PDE2A 1306/4885NPY5R 965/4885ENPP2 2983/4885

“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.

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