SCHEMBL14770565

SCHEMBL14770565

COc1ccc(C(O)c2nc3cc(C(C)=O)ccc3[nH]2)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 2/20 0.49
MLKL Q8NB16 5/20 0.45
GSK3B P49841 1/20 0.43
MTNR1B P49286 2/20 0.41
MTNR1A P48039 1/20 0.41
NPC1 O15118 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
RAB9A P51151 2/20 0.40
PKM P14618 1/20 0.40
PDE10A Q9Y233 1/20 0.40
COMT P21964 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL12065306 0.86 MTOR (0.43) CHEK2MLKLMEN1KMT2APDE10A
SCHEMBL14770690 0.86 MLKL (0.52) CHEK2MLKLMTNR1BMTNR1ANPC1
SCHEMBL12066577 0.83 MLKL (0.59) CHEK2MLKLNPC1MEN1KMT2A
SCHEMBL14770701 0.83 MLKL (0.49) CHEK2MLKLMTNR1BMTNR1AMEN1
SCHEMBL14770699 0.82 MLKL (0.46) CHEK2MLKLMTNR1BMTNR1ANPC1
SCHEMBL14770608 0.81 MLKL (0.48) CHEK2MLKLMTNR1BMTNR1AMEN1
SCHEMBL14770470 0.81 MLKL (0.48) CHEK2MLKLMTNR1BMTNR1AMEN1
SCHEMBL14770697 0.81 MLKL (0.51) CHEK2MLKLMTNR1BMTNR1AMEN1
SCHEMBL14770471 0.80 MEN1 (0.55) CHEK2MLKLMTNR1BMTNR1ANPC1
SCHEMBL14770512 0.79 MEN1 (0.51) MLKLNPC1MEN1KMT2ARAB9A

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 2 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-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE TOA EIYO LTD. (JP) 2013-03-14 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-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE CACNA1E, CACNA1G, CACNA1A CHEK2 1636/4885MLKL 2378/4885GSK3B 3938/4885

“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.