SCHEMBL12066005

SCHEMBL12066005

CCOc1ccc2[nH]c(C(O)c3ccc(OC(F)(F)F)cc3)nc2c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.51
HTT P42858 1/20 0.51
KMT2A Q03164 1/20 0.51
MLKL Q8NB16 2/20 0.43
SCN10A Q9Y5Y9 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
PDE2A O00408 6/20 0.39
TOP2A P11388 1/20 0.38
TOP2B Q02880 1/20 0.38
PDE10A Q9Y233 1/20 0.36
POLB P06746 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
ESR2 Q92731 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 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
SCHEMBL12066573 0.90 SCN10A (0.46) KMT2AMLKLSCN10APDE2ATOP2A
SCHEMBL12065285 0.87 SCN10A (0.46) MEN1KMT2AMLKLSCN10APDE2A
SCHEMBL12065656 0.87 MEN1 (0.45) MEN1HTTKMT2AMLKLSCN10A
SCHEMBL14770471 0.86 MEN1 (0.55) MEN1HTTKMT2AMLKLL3MBTL1
SCHEMBL12065280 0.86 MLKL (0.46) MEN1HTTKMT2AMLKLSCN10A
SCHEMBL12066012 0.86 MEN1 (0.45) MEN1HTTKMT2AMLKLSCN10A
SCHEMBL14770707 0.85 SCN10A (0.48) MEN1KMT2AMLKLSCN10APDE2A
SCHEMBL12066600 0.84 SCN10A (0.45) MEN1KMT2AMLKLSCN10APDE2A
SCHEMBL12065627 0.84 MEN1 (0.46) MEN1HTTKMT2AMLKLSCN10A
SCHEMBL12065245 0.84 ALPL (0.44) KMT2AMLKLSCN10APDE2ATOP2A

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
US-9096531-B2 Fused imidazole derivative TOA EIYO LTD. (JP) 2015-08-04 US disclosed
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
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 MEN1 2676/4885HTT 3959/4885KMT2A 4545/4885

“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.