SCHEMBL12065640

SCHEMBL12065640

OC(c1ccc(OC(F)(F)F)c(Cl)c1)c1nc2cc(F)ccc2[nH]1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.40
ALPI P09923 1/20 0.40
ALPG P10696 1/20 0.40
MLKL Q8NB16 2/20 0.39
PDE2A O00408 3/20 0.38
GRIN2B Q13224 5/20 0.36
KMO O15229 2/20 0.36
BRD4 O60885 1/20 0.35
EGLN1 Q9GZT9 1/20 0.34
F9 P00740 1/20 0.34
GAA P10253 1/20 0.34
MAP2 P11137 1/20 0.34
AKT1 P31749 1/20 0.33
GRIA1 P42261 1/20 0.33
CACNG8 Q8WXS5 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
SCHEMBL12066571 0.89 PDE2A (0.43) ALPLALPIALPGMLKLPDE2A
SCHEMBL14763165 0.87 ALPL (0.40) ALPLALPIALPGMLKLPDE2A
SCHEMBL12065625 0.87 MLKL (0.55) MLKLPDE2AGRIN2BKMOF9
SCHEMBL14770671 0.87 MLKL (0.43) ALPLALPIALPGMLKLBRD4
SCHEMBL12065634 0.86 MLKL (0.40) MLKLPDE2AGRIN2BKMOF9
SCHEMBL12065658 0.85 MLKL (0.43) ALPLALPIALPGMLKLPDE2A
SCHEMBL12065245 0.83 ALPL (0.44) ALPLALPIALPGMLKLPDE2A
SCHEMBL14762969 0.83 GRIN2B (0.36) PDE2AGRIN2BKMOBRD4EGLN1
SCHEMBL14770488 0.77 BRD4 (0.43) ALPLALPIALPGMLKLBRD4
SCHEMBL12065613 0.77 ALPL (0.47) ALPLALPIALPGMLKLPDE2A

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
US-9096531-B2 Fused imidazole derivative TOA EIYO LTD. (JP) 2015-08-04 US claimed
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 ALPL 4272/4885ALPI 3147/4885ALPG 3384/4885

“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.