SCHEMBL6319728

SCHEMBL6319728

NC(=O)c1c(-c2ccncc2)noc1NC(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBK1 Q9UHD2 1/20 0.52
MAPK14 Q16539 2/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
MAPK1 P28482 1/20 0.51
KMT2A Q03164 3/20 0.50
GAA P10253 2/20 0.50
MEN1 O00255 1/20 0.50
JAK2 O60674 1/20 0.49
TYK2 P29597 1/20 0.49
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 4/20 0.48
HTT P42858 3/20 0.48
TP53 P04637 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HDAC2 Q92769 1/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA4 P22748 2/20 0.46

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
SCHEMBL6317649 0.94 SMN1; SMN2 (0.54) TBK1MAPK14SMN1; SMN2MAPK1KMT2A
SCHEMBL6318347 0.88 IKBKE (0.54) TBK1MAPK14SMN1; SMN2MAPK1KMT2A
SCHEMBL6319348 0.88 MAPK14 (0.54) TBK1MAPK14SMN1; SMN2KMT2AMEN1
SCHEMBL6317602 0.88 KMT2A (0.51) SMN1; SMN2MAPK1KMT2AMEN1ALDH1A1
SCHEMBL6319264 0.86 NPC1 (0.47) MAPK14STAT3KDR
SCHEMBL6318091 0.86 NPC1 (0.55) TBK1SMN1; SMN2MAPK1KMT2AGAA
SCHEMBL6318264 0.86 PARP1 (0.43) TBK1MAPK14SMN1; SMN2MAPK1KMT2A
SCHEMBL6315634 0.86 FLT3 (0.47) SMN1; SMN2KMT2AMEN1ALDH1A1KDM4E
SCHEMBL6322937 0.86 CYP1A2 (0.48) MAPK14SMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL6322794 0.86 NT5E (0.55) SMN1; SMN2MAPK1KMT2AGAAMEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US claimed
EP-1435948-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP claimed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO claimed
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US disclosed
EP-1435948-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP disclosed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO 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-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors MAP3K9, MAP3K19, MAP4K2 TBK1 73/4885MAPK14 111/4885SMN1; SMN2 2766/4885

“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.