SCHEMBL14770477

SCHEMBL14770477

Cc1ccc(C(O)c2nc3cc(F)ccc3[nH]2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLKL Q8NB16 4/20 0.66
ALPL P05186 1/20 0.49
ALPI P09923 1/20 0.49
ALPG P10696 1/20 0.49
ALDH1A1 P00352 3/20 0.46
HPGD P15428 2/20 0.46
USP2 O75604 2/20 0.46
HTT P42858 1/20 0.46
CYP1A2 P05177 1/20 0.44
KDM4E B2RXH2 1/20 0.39
CHEK2 O96017 1/20 0.39
BRD4 O60885 1/20 0.39
SCN10A Q9Y5Y9 1/20 0.37
KIF11 P52732 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
IDO1 P14902 1/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 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
SCHEMBL14770470 0.85 MLKL (0.48) MLKLALPLALPIALPGALDH1A1
SCHEMBL14770474 0.85 MLKL (0.48) MLKLALPLALPIALPGALDH1A1
SCHEMBL14770483 0.85 MLKL (0.48) MLKLALPLALPIALPGALDH1A1
SCHEMBL14770501 0.84 MLKL (0.46) MLKLALPLALPIALPGALDH1A1
SCHEMBL12065631 0.84 MLKL (0.52) MLKLALPLALPIALPGALDH1A1
SCHEMBL12065613 0.84 ALPL (0.47) MLKLALPLALPIALPGSCN10A
SCHEMBL14770491 0.82 KMT2A (0.51) MLKLALPLALPIALPGHTT
SCHEMBL12065618 0.81 MLKL (0.52) MLKLALPLALPIALPGALDH1A1
SCHEMBL12065617 0.81 ALPL (0.44) MLKLALPLALPIALPG
SCHEMBL14770666 0.81 MLKL (0.59) MLKLALDH1A1HPGDUSP2HTT

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 MLKL 2378/4885ALPL 4272/4885ALPI 3147/4885

“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.