SCHEMBL3395968

SCHEMBL3395968

CCS(=O)(=O)N1CCC(c2n[nH]c3c(C(N)=O)cc(-c4cccnc4)cc23)CC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 13/20 0.56
CHUK O15111 4/20 0.56
AURKA O14965 1/20 0.51
FLT3 P36888 1/20 0.51
CSNK1E P49674 1/20 0.51
BTK Q06187 1/20 0.51
ALDH1A1 P00352 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
JAK2 O60674 1/20 0.41
DYRK1A Q13627 1/20 0.39
MKNK1 Q9BUB5 3/20 0.39
MKNK2 Q9HBH9 3/20 0.39

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
SCHEMBL3391403 0.90 IKBKB (0.69) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3392939 0.86 IKBKB (0.56) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3393169 0.85 IKBKB (0.56) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3395187 0.85 IKBKB (0.57) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3395402 0.84 IKBKB (0.55) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3396364 0.84 IKBKB (0.54) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3393266 0.83 MKNK1 (0.53) IKBKBCHUKBTKDYRK1AMKNK1
SCHEMBL3392308 0.83 IKBKB (0.53) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3392932 0.83 IKBKB (0.53) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3395831 0.83 IKBKB (0.53) IKBKBCHUKAURKAFLT3CSNK1E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8501780-B2 Indazole carboxamides and their use GLAXOSMITHKLINE LLC (US) 2013-08-06 US disclosed
US-8501780-B2 Indazole carboxamides and their use GLAXOSMITHKLINE LLC (US) 2013-08-06 US disclosed
US-8501780-B2 Indazole carboxamides and their use GLAXOSMITHKLINE LLC (US) 2013-08-06 US disclosed
EP-1758578-B1 NOVEL INDAZOLE CARBOXAMIDES AND THEIR USE GLAXOSMITHKLINE LLC (US) 2010-12-29 EP disclosed
EP-1758578-B1 NOVEL INDAZOLE CARBOXAMIDES AND THEIR USE GLAXOSMITHKLINE LLC (US) 2010-12-29 EP disclosed
EP-1758578-A4 NOVEL INDAZOLE CARBOXAMIDES AND THEIR USE SMITHKLINE BEECHAM CORP (US) 2009-05-27 EP disclosed
US-20070281933-A1 Novel Indazole Carboxamides And Their Use SMITHKLINE BEECHAM CORPORATION (US) 2007-12-06 US disclosed
US-20070281933-A1 Novel Indazole Carboxamides And Their Use SMITHKLINE BEECHAM CORPORATION (US) 2007-12-06 US disclosed
US-20070281933-A1 Novel Indazole Carboxamides And Their Use SMITHKLINE BEECHAM CORPORATION (US) 2007-12-06 US disclosed
EP-1758578-A2 NOVEL INDAZOLE CARBOXAMIDES AND THEIR USE Smithkline Beecham Corporation (US) 2007-03-07 EP disclosed
WO-2006002434-A2 NOVEL INDAZOLE CARBOXAMIDES AND THEIR USE SMITHKLINE BEECHAM CORPORATION (US) 2006-01-05 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-20070281933-A1 Novel Indazole Carboxamides And Their Use IKBKG, IRAK2, NFKBIA IKBKB 8/4885CHUK 9/4885AURKA 642/4885

“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.