SCHEMBL5207334

SCHEMBL5207334

NC(=O)Nc1sc(Br)cc1C(N)=O.[Ar]

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 14/20 0.54
JAK2 O60674 2/20 0.54
JAK3 P52333 1/20 0.54
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
EIF2AK2 P19525 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
CHEK1 O14757 5/20 0.48
ALDH1A1 P00352 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL491042 0.98 IKBKB (0.55) IKBKBJAK2JAK3MEN1KMT2A
Bicarbonate SCHEMBL5978745 0.92 IKBKB (0.50) IKBKBJAK2JAK3MEN1KMT2A
Bicarbonate SCHEMBL5978736 0.92 IKBKB (0.50) IKBKBJAK2JAK3MEN1KMT2A
Bicarbonate SCHEMBL5978731 0.90 IKBKB (0.52) IKBKBJAK2JAK3MEN1KMT2A
SCHEMBL6611048 0.86 PTK2 (0.55) IKBKBJAK2JAK3MEN1KMT2A
SCHEMBL5556399 0.86 IKBKB (0.46) IKBKBJAK2JAK3MEN1KMT2A
SCHEMBL13930117 0.84 IKBKB (0.42) IKBKBJAK2JAK3MEN1KMT2A
SCHEMBL5105544 0.84 MEN1 (0.59) IKBKBJAK2JAK3MEN1KMT2A
SCHEMBL1563630 0.81 CHEK1 (0.45) IKBKBJAK2JAK3MEN1KMT2A
SCHEMBL7055093 0.81 IKBKB (0.43) IKBKBJAK2JAK3MEN1KMT2A

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 5 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 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
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.