SCHEMBL6318347

SCHEMBL6318347

Cc1ccc(C(=O)Nc2onc(-c3ccncc3)c2C(N)=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKE Q14164 2/20 0.54
TBK1 Q9UHD2 2/20 0.54
ALDH1A1 P00352 7/20 0.50
KDM4E B2RXH2 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
TP53 P04637 1/20 0.50
THRB P10828 1/20 0.50
RAB9A P51151 1/20 0.50
POLB P06746 2/20 0.48
LMNA P02545 2/20 0.48
MAPK1 P28482 1/20 0.46
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
GAA P10253 2/20 0.45
ITK Q08881 1/20 0.45
HTT P42858 1/20 0.43
TDP1 Q9NUW8 2/20 0.43
MAPK14 Q16539 1/20 0.43
HPGD P15428 2/20 0.43

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
SCHEMBL6317602 0.88 KMT2A (0.51) ALDH1A1SMN1; SMN2L3MBTL1TP53RAB9A
SCHEMBL6319348 0.88 MAPK14 (0.54) IKBKETBK1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL6319728 0.88 TBK1 (0.52) TBK1ALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL6315817 0.87 ITK (0.47) IKBKETBK1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL6321751 0.87 SMN1; SMN2 (0.53) ALDH1A1KDM4ESMN1; SMN2TP53RAB9A
SCHEMBL6317649 0.87 SMN1; SMN2 (0.54) TBK1ALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL6319264 0.87 NPC1 (0.47) MAPK14TRPV1
SCHEMBL6322794 0.86 NT5E (0.55) ALDH1A1KDM4ESMN1; SMN2THRBRAB9A
SCHEMBL6317627 0.86 NAMPT (0.52) IKBKETBK1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL6323363 0.85 P2RY14 (0.47) IKBKETBK1ALDH1A1KDM4ESMN1; SMN2

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 IKBKE 80/4885TBK1 73/4885ALDH1A1 4444/4885

“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.