SCHEMBL5208638

SCHEMBL5208638

NC(=O)Nc1sc(-c2cccc3cccnc23)cc1C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 4/20 0.57
JAK2 O60674 3/20 0.57
JAK3 P52333 2/20 0.57
MEN1 O00255 1/20 0.52
EIF2AK2 P19525 1/20 0.52
KMT2A Q03164 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
PARP1 P09874 1/20 0.51
CHEK1 O14757 9/20 0.49
MAP4K4 O95819 1/20 0.44

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
SCHEMBL1681706 0.80 IKBKB (0.67) IKBKBJAK2JAK3MEN1EIF2AK2
SCHEMBL19206637 0.79 PARP1 (0.56) IKBKBJAK2JAK3MEN1EIF2AK2
SCHEMBL4093060 0.76 JAK2 (0.64) IKBKBJAK2JAK3MEN1EIF2AK2
SCHEMBL10051836 0.76 IKBKB (0.68) IKBKBJAK2JAK3MEN1EIF2AK2
SCHEMBL7053472 0.75 IKBKB (0.66) IKBKBJAK2JAK3MEN1EIF2AK2
SCHEMBL1929743 0.74 CHEK1 (0.50) IKBKBJAK2JAK3MEN1EIF2AK2
SCHEMBL4088216 0.74 IKBKB (0.74) IKBKBJAK2JAK3MEN1EIF2AK2
SCHEMBL1385889 0.74 JAK2 (1.00) IKBKBJAK2JAK3MEN1EIF2AK2
SCHEMBL4086973 0.74 JAK2 (0.72) IKBKBJAK2JAK3MEN1EIF2AK2
SCHEMBL27585211 0.73 PARP1 (0.53) IKBKBMEN1KMT2ATDP1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1421079-B1 THIOPHENYL COMPOUNDS AS MEDICAMENTS ASTRAZENECA AB (SE) 2007-02-07 EP claimed
US-7098240-B2 Compounds ASTRAZENECA AB (SE) 2006-08-29 US claimed
US-20040235821-A1 Novel compounds ASTRAZENECA AB (SE) 2004-11-25 US claimed
CN-1538968-A Novel compounds 2004-10-20 CN claimed
EP-1421079-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2004-05-26 EP claimed
WO-2003010163-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2003-02-06 WO claimed
EP-1421079-B1 THIOPHENYL COMPOUNDS AS MEDICAMENTS ASTRAZENECA AB (SE) 2007-02-07 EP disclosed
US-7098240-B2 Compounds ASTRAZENECA AB (SE) 2006-08-29 US disclosed
US-20040235821-A1 Novel compounds ASTRAZENECA AB (SE) 2004-11-25 US disclosed
CN-1538968-A Novel compounds 2004-10-20 CN disclosed
EP-1421079-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2004-05-26 EP disclosed
WO-2003010163-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2003-02-06 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-20040235821-A1 Novel compounds ABCG2, UGT1A1, SULT1E1 IKBKB 2823/4885JAK2 378/4885JAK3 656/4885

“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.