SCHEMBL8258334

SCHEMBL8258334

Nc1cccc(-c2n[nH]c3ccc(-c4nnn[nH]4)cc23)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 2/20 0.58
PDPK1 O15530 1/20 0.48
TTK P33981 1/20 0.45
MKNK1 Q9BUB5 1/20 0.44
JAK2 O60674 3/20 0.43
AXL P30530 3/20 0.41
ENPP2 Q13822 1/20 0.40
MAP2K4 P45985 2/20 0.40
CLK2 P49760 4/20 0.40
DYRK1A Q13627 4/20 0.40
CLK3 P49761 2/20 0.40
PRKD3 O94806 2/20 0.40
MAP4K4 O95819 2/20 0.40
CDK2 P24941 2/20 0.40
MARK3 P27448 2/20 0.40
FLT3 P36888 2/20 0.40
MAPK9 P45984 2/20 0.40
CSNK1D P48730 2/20 0.40
CSNK2A1 P68400 2/20 0.40
CSNK1G2 P78368 2/20 0.40

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
SCHEMBL8365109 0.85 MKNK1 (0.60) TTKMKNK1JAK2AXLMAP2K4
SCHEMBL8257794 0.85 CDK2 (0.45) AURKAPDPK1TTKMKNK1JAK2
SCHEMBL29581828 0.83 ENPP2 (0.54) AURKAPDPK1MKNK1AXLENPP2
SCHEMBL266617 0.83 ENPP2 (0.54) AURKAPDPK1MKNK1AXLENPP2
Hydrochloric Acid SCHEMBL27945737 0.82 ENPP2 (0.53) AURKAPDPK1MKNK1AXLENPP2
Hydrochloric Acid SCHEMBL6177189 0.82 ENPP2 (0.53) AURKAPDPK1MKNK1AXLENPP2
SCHEMBL28518684 0.82 ENPP2 (0.53) AURKAPDPK1MKNK1AXLENPP2
SCHEMBL28515571 0.82 ENPP2 (0.53) AURKAPDPK1MKNK1AXLENPP2
SCHEMBL28523028 0.82 ENPP2 (0.53) AURKAPDPK1MKNK1AXLENPP2
SCHEMBL8260189 0.81 TTK (0.51) AURKATTKMKNK1JAK2CLK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7220771-B2 Methods of using indazole derivatives as JNK inhibitors SIGNAL PHARMACEUTICALS, LLC (US) 2007-05-22 US disclosed
US-7220771-B2 Methods of using indazole derivatives as JNK inhibitors SIGNAL PHARMACEUTICALS, LLC (US) 2007-05-22 US disclosed
US-7211594-B2 Indazole compounds and compositions thereof as JNK inhibitors and for the treatment of diseases associated therewith SIGNAL PHARMACEUTICALS, LLC (US) 2007-05-01 US disclosed
US-7211594-B2 Indazole compounds and compositions thereof as JNK inhibitors and for the treatment of diseases associated therewith SIGNAL PHARMACEUTICALS, LLC (US) 2007-05-01 US disclosed
US-7208513-B2 Indazole compounds and compositions thereof as JNK inhibitors and for the treatment of diseases associated therewith SIGNAL PHARMACEUTICALS, LLC (US) 2007-04-24 US disclosed
US-7208513-B2 Indazole compounds and compositions thereof as JNK inhibitors and for the treatment of diseases associated therewith SIGNAL PHARMACEUTICALS, LLC (US) 2007-04-24 US disclosed
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds SIGNAL PHARMACEUTICALS, LLC 2007-03-15 US disclosed
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds SIGNAL PHARMACEUTICALS, LLC 2007-03-15 US disclosed
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC 2005-01-13 US disclosed
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC 2005-01-13 US disclosed
US-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK SIGNAL PHARMACEUTICALS, LLC 2004-07-01 US disclosed
US-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK SIGNAL PHARMACEUTICALS, LLC 2004-07-01 US disclosed
WO-2002010137-A9 INDAZOLE DERIVATIVES AS JNK INHIBITORS SIGNAL PHARM INC (US) 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 (3 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-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK MAPK1, MAP3K1, MAPKAPK2 AURKA 3307/4885PDPK1 351/4885TTK 1198/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT AURKA 2787/4885PDPK1 2784/4885TTK 2139/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R AURKA 1439/4885PDPK1 41/4885TTK 714/4885

“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.