SCHEMBL8254064

SCHEMBL8254064

NC(=O)c1ccc2[nH]nc(-c3cccc(NC(=O)C4CCNCC4)c3)c2c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 4/20 0.59
AAK1 Q2M2I8 4/20 0.53
MAP2K4 P45985 1/20 0.52
ROCK1 Q13464 1/20 0.50
PDPK1 O15530 1/20 0.48
CSNK2A1 P68400 1/20 0.48
ITK Q08881 1/20 0.47
TTK P33981 2/20 0.47
MAPK8 P45983 2/20 0.47
AURKA O14965 3/20 0.46
MAP2K7 O14733 1/20 0.45
GAK O14976 1/20 0.45
STK16 O75716 1/20 0.45
BMP2K Q9NSY1 1/20 0.45
IP6K1 Q92551 1/20 0.45
IP6K3 Q96PC2 1/20 0.45
IP6K2 Q9UHH9 1/20 0.45

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
SCHEMBL5381639 0.95 AAK1 (0.59) ULK1AAK1MAP2K4PDPK1CSNK2A1
SCHEMBL5382027 0.87 MAPK10 (0.58) ULK1AAK1MAP2K4PDPK1CSNK2A1
SCHEMBL2865036 0.84 PDPK1 (0.65) ULK1AAK1PDPK1CSNK2A1ITK
SCHEMBL5377947 0.83 MAP2K4 (0.63) MAP2K4TTKMAPK8AURKAMAP2K7
SCHEMBL12073910 0.82 TTK (0.65) MAP2K4ITKTTKMAPK8AURKA
SCHEMBL5785886 0.81 AURKA (0.66) MAP2K4ITKTTKMAPK8AURKA
SCHEMBL5374309 0.79 ROCK2 (0.49) ULK1MAP2K4TTKMAPK8AURKA
SCHEMBL5374305 0.79 MAP2K4 (0.46) ULK1MAP2K4TTKMAPK8AURKA
SCHEMBL6545151 0.78 TTK (0.49) ULK1AAK1PDPK1CSNK2A1ITK
SCHEMBL6793415 0.78 PARP1 (0.60) ULK1ROCK1CSNK2A1

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 ULK1 179/4885AAK1 150/4885MAP2K4 130/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT ULK1 2079/4885AAK1 3487/4885MAP2K4 3021/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R ULK1 176/4885AAK1 652/4885MAP2K4 385/4885

“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.