SCHEMBL14770491

SCHEMBL14770491

CCOc1ccc(C(O)c2nc3cc(F)ccc3[nH]2)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
HTT P42858 1/20 0.51
MLKL Q8NB16 2/20 0.45
ALPL P05186 1/20 0.43
ALPI P09923 1/20 0.43
ALPG P10696 1/20 0.43
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 2/20 0.40
BRD4 O60885 1/20 0.40
CREBBP Q92793 1/20 0.40
MAPK1 P28482 5/20 0.38
PDE10A Q9Y233 2/20 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
SCHEMBL12065620 0.88 CACNA1C (0.48) KMT2AMEN1HTTMLKLALPL
SCHEMBL14770508 0.87 KMT2A (0.49) KMT2AMEN1HTTALPLALPI
SCHEMBL14770470 0.86 MLKL (0.48) KMT2AMEN1HTTMLKLALPL
SCHEMBL12066561 0.86 PRCP (0.43) KMT2AMEN1HTTMLKLALPL
SCHEMBL14770471 0.84 MEN1 (0.55) KMT2AMEN1HTTMLKLPOLB
SCHEMBL12066005 0.83 MEN1 (0.51) KMT2AMEN1HTTMLKLPOLB
SCHEMBL14770477 0.82 MLKL (0.66) KMT2AHTTMLKLALPLALPI
SCHEMBL12065245 0.82 ALPL (0.44) KMT2AMLKLALPLALPIALPG
SCHEMBL12066575 0.82 MLKL (0.44) KMT2AMEN1HTTMLKLALPL
SCHEMBL12065616 0.80 ALPL (0.42) KMT2AMEN1HTTMLKLALPL

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 KMT2A 4545/4885MEN1 2676/4885HTT 3959/4885

“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.