SCHEMBL3619293

SCHEMBL3619293

Cc1cc(CN(C)Cc2ccc(-c3cc(NC(N)=O)c(C(N)=O)s3)cc2)on1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 13/20 0.51
CHEK1 O14757 4/20 0.48
MAP3K7 O43318 1/20 0.47
MAPK1 P28482 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
SCHEMBL3614444 0.84 IKBKB (0.68) IKBKBCHEK1MAP3K7
SCHEMBL3619297 0.82 IKBKB (0.50) IKBKBCHEK1MAP3K7MAPK1
SCHEMBL3618767 0.82 IKBKB (0.61) IKBKBCHEK1MAP3K7
SCHEMBL3610867 0.80 CHEK1 (0.73) IKBKBCHEK1MAP3K7
SCHEMBL3608243 0.79 IKBKB (0.55) IKBKBCHEK1MAP3K7
SCHEMBL3612207 0.77 MAP3K7 (0.62) IKBKBCHEK1MAP3K7
SCHEMBL3619014 0.77 CHEK1 (0.57) IKBKBCHEK1MAP3K7
SCHEMBL3615111 0.75 CHEK1 (0.52) IKBKBCHEK1MAP3K7
SCHEMBL1384269 0.72 PTPRF (0.65) IKBKBCHEK1MAP3K7
SCHEMBL3615407 0.71 IKBKB (0.64) IKBKBCHEK1MAP3K7

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
US-20100029754-A1 THIOPHENE-CARBOXAMIDE DERIVATIVES AND THEIR USE AS INHIBITORS OF THE ENZYME IKK-2 ASTRAZENECA AB (SW) 2010-02-04 US disclosed
US-7572826-B2 Thiophene-carboxamide derivatives and their use as inhibitors of the enzyme IKK-2 ASTRAZENECA AB (SE) 2009-08-11 US disclosed
US-20060058522-A1 Thiophene-carboxamide derivatives and their use as inhibitors of the enzyme ikk-2 ASTRAZENECA AB (SE) 2006-03-16 US disclosed
EP-1583755-A1 THIOPHENE-CARBOXAMIDE DERIVATIVES AND THEIR USE AS INHIBITORS OF THE ENZIME IKK-2 AstraZeneca AB (SE) 2005-10-12 EP disclosed
WO-2004063186-A1 THIOPHENE-CARBOXAMIDE DERIVATIVES AND THEIR USE AS INHIBITORS OF THE ENZIME IKK-2 ASTRAZENECA AB (SE) 2004-07-29 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 (2 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-20060058522-A1 Thiophene-carboxamide derivatives and their use as inhibitors of the enzyme ikk-2 NFKBIA, RELA, IKBKE IKBKB 5/4885CHEK1 487/4885MAP3K7 129/4885
US-20100029754-A1 THIOPHENE-CARBOXAMIDE DERIVATIVES AND THEIR USE AS INHIBITORS OF THE ENZYME IKK-2 NFKBIA, RELA, IKBKE IKBKB 5/4885CHEK1 487/4885MAP3K7 129/4885

“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.