SCHEMBL3391372

SCHEMBL3391372

NC(=O)c1cc(-c2cn[nH]c2)cc2c(C3CCNCC3)n[nH]c12

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 9/20 0.47
CHUK O15111 2/20 0.47
CSF1R P07333 1/20 0.38
BTK Q06187 1/20 0.38
JAK2 O60674 3/20 0.38
CHEK1 O14757 1/20 0.38
JAK3 P52333 2/20 0.37
KCNH2 Q12809 2/20 0.37
PARP1 P09874 1/20 0.37
CDC7 O00311 1/20 0.36
PLAT P00750 1/20 0.35
ROCK2 O75116 1/20 0.34
MKNK1 Q9BUB5 1/20 0.34
MKNK2 Q9HBH9 1/20 0.34

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
SCHEMBL3391461 0.84 IKBKB (0.64) IKBKBCHUKCSF1RBTK
Hydrochloric Acid SCHEMBL3395054 0.83 IKBKB (0.63) IKBKBCHUKCSF1RBTK
SCHEMBL3393266 0.81 MKNK1 (0.53) IKBKBCHUKCSF1RBTKCHEK1
SCHEMBL3394095 0.81 GPR119 (0.47) JAK2JAK3
SCHEMBL14365503 0.81 KDM5A (0.38) IKBKBCHUKBTKJAK2JAK3
Hydrochloric Acid SCHEMBL3395364 0.81 MKNK1 (0.52) IKBKBCHUKCSF1RBTKCHEK1
SCHEMBL3393077 0.80 IKBKB (0.47) IKBKBCHUKCSF1RBTKCHEK1
SCHEMBL3396344 0.80 IKBKB (0.49) IKBKBCHUKCSF1RBTKPARP1
Hydrochloric Acid SCHEMBL3396662 0.79 IKBKB (0.46) IKBKBCHUKCSF1RBTKCHEK1
SCHEMBL3391348 0.79 IKBKB (0.51) IKBKBCHUKCSF1RBTKCHEK1

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-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
CN-101005836-A Novel indazole carboxamides and their use SMITHKLINE BEECHAM CORP (US) 2007-07-25 CN 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 9/4885CSF1R 1544/4885

“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.