SCHEMBL14770488

SCHEMBL14770488

COc1ccc(C(O)c2nc3cc(F)ccc3[nH]2)cc1F

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 3/20 0.43
ALPL P05186 1/20 0.43
ALPI P09923 1/20 0.43
ALPG P10696 1/20 0.43
MLKL Q8NB16 2/20 0.42
AMY1A P0DUB6 6/20 0.39
CFB P00751 1/20 0.38
TRPA1 O75762 2/20 0.37
AHR P35869 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
PDGFRB P09619 1/20 0.36
PDGFRA P16234 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
SCHEMBL14770671 0.88 MLKL (0.43) BRD4ALPLALPIALPGMLKL
SCHEMBL14770490 0.88 AMY1A (0.43) BRD4ALPLALPIALPGMLKL
SCHEMBL14770723 0.87 MLKL (0.45) BRD4ALPLALPIALPGMLKL
SCHEMBL14770504 0.87 BRD4 (0.42) BRD4ALPLALPIALPGAMY1A
SCHEMBL12066571 0.86 PDE2A (0.43) BRD4ALPLALPIALPGMLKL
SCHEMBL14770470 0.84 MLKL (0.48) BRD4ALPLALPIALPGMLKL
SCHEMBL14770483 0.84 MLKL (0.48) BRD4ALPLALPIALPGMLKL
SCHEMBL14770477 0.80 MLKL (0.66) BRD4ALPLALPIALPGMLKL
SCHEMBL12065614 0.80 ALPL (0.44) ALPLALPIALPGMLKLTRPA1
SCHEMBL12065658 0.78 MLKL (0.43) BRD4ALPLALPIALPGMLKL

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 BRD4 1580/4885ALPL 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.