SCHEMBL14770671

SCHEMBL14770671

COc1ccc(C(O)c2nc3cc(F)ccc3[nH]2)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MLKL Q8NB16 2/20 0.43
ALPL P05186 1/20 0.41
ALPI P09923 1/20 0.41
ALPG P10696 1/20 0.41
AMY1A P0DUB6 6/20 0.40
CFB P00751 1/20 0.39
BRD4 O60885 2/20 0.38
F9 P00740 2/20 0.36
F10 P00742 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C8 P10632 1/20 0.36
CYP2C9 P11712 1/20 0.36
KCNH2 Q12809 1/20 0.36
AHR P35869 1/20 0.36
GAA P10253 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL14770488 0.88 BRD4 (0.43) MLKLALPLALPIALPGAMY1A
SCHEMBL14770682 0.87 AMY1A (0.41) MLKLALPLALPIALPGAMY1A
SCHEMBL14770673 0.87 MLKL (0.44) MLKLCFBCYP3A4CYP2C8CYP2C9
SCHEMBL12065640 0.87 ALPL (0.40) MLKLALPLALPIALPGBRD4
SCHEMBL14770490 0.86 AMY1A (0.43) MLKLALPLALPIALPGAMY1A
SCHEMBL14770723 0.85 MLKL (0.45) MLKLALPLALPIALPGAMY1A
SCHEMBL14770672 0.85 MLKL (0.62) MLKLAMY1ACFBCYP3A4CYP2C9
SCHEMBL14770470 0.82 MLKL (0.48) MLKLALPLALPIALPGAMY1A
SCHEMBL12065634 0.80 MLKL (0.40) MLKLCFBF9
SCHEMBL14770477 0.78 MLKL (0.66) MLKLALPLALPIALPGBRD4

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.