SCHEMBL3395375

SCHEMBL3395375

NC(=O)c1cc(-c2ccsc2)cc2c(C3CCN(S(=O)(=O)CCCCl)CC3)n[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 13/20 0.46
CHUK O15111 4/20 0.44
AURKA O14965 1/20 0.44
FLT3 P36888 1/20 0.44
CSNK1E P49674 1/20 0.44
BTK Q06187 1/20 0.44
RPS6KB1 P23443 2/20 0.39
PDPK1 O15530 1/20 0.39
CNR1 P21554 3/20 0.34
CHEK1 O14757 1/20 0.33
KCNH2 Q12809 1/20 0.33
KDM5A P29375 1/20 0.32

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
SCHEMBL3392932 0.90 IKBKB (0.53) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3392499 0.90 IKBKB (0.58) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3390020 0.90 IKBKB (0.52) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3392290 0.88 IKBKB (0.58) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3391228 0.88 IKBKB (0.60) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3393350 0.86 IKBKB (0.45) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3391386 0.85 IKBKB (0.50) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3802581 0.85 IKBKB (0.64) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL3395580 0.83 IKBKB (0.41) IKBKBCHUKAURKAFLT3CSNK1E
SCHEMBL27698208 0.81 RPS6KB1 (0.40) 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 6 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
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
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.