SCHEMBL14770470

SCHEMBL14770470

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MLKL Q8NB16 2/20 0.48
▸ ALPL P05186 1/20 0.46
▸ ALPI P09923 1/20 0.46
▸ ALPG P10696 1/20 0.46
▸ FLT3 P36888 2/20 0.42
▸ CHEK2 O96017 1/20 0.42
▸ AMY1A P0DUB6 1/20 0.41
▸ MTNR1A P48039 2/20 0.41
▸ MTNR1B P49286 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ PDE10A Q9Y233 2/20 0.38
▸ ATM Q13315 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
SCHEMBL14770690 0.89 MLKL (0.52) MLKLCHEK2MTNR1AMTNR1BKDM4E
SCHEMBL14770491 0.86 KMT2A (0.51) MLKLALPLALPIALPGLMNA
SCHEMBL14770492 0.86 AMY1A (0.41) ALPLALPIALPGFLT3AMY1A
SCHEMBL14770722 0.86 MLKL (0.46) MLKLALPLALPIALPGCHEK2
SCHEMBL12066577 0.86 MLKL (0.59) MLKLFLT3CHEK2KDM4EGAA
SCHEMBL14770701 0.86 MLKL (0.49) MLKLFLT3CHEK2MTNR1AMTNR1B
SCHEMBL14770477 0.85 MLKL (0.66) MLKLALPLALPIALPGCHEK2
SCHEMBL14770699 0.85 MLKL (0.46) MLKLCHEK2MTNR1AMTNR1BLMNA
SCHEMBL12065245 0.85 ALPL (0.44) MLKLALPLALPIALPGKDM4E
SCHEMBL14770697 0.85 MLKL (0.51) MLKLFLT3CHEK2AMY1AMTNR1A

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.

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