SCHEMBL5387657

SCHEMBL5387657

O=C(NCc1ccccc1)Nc1cccc(-c2n[nH]c3ccc(-c4nc[nH]n4)cc23)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AURKA O14965 6/20 0.54
NAMPT P43490 2/20 0.53
ITK Q08881 1/20 0.51
MAPK1 P28482 4/20 0.49
TTK P33981 3/20 0.49
MAPK8 P45983 1/20 0.48
MAPK3 P27361 1/20 0.48
ROCK2 O75116 2/20 0.47
PRKCA P17252 1/20 0.47
GRK2 P25098 1/20 0.47
KDR P35968 1/20 0.47
BRAF P15056 1/20 0.46
ROCK1 Q13464 1/20 0.46
MAP2K7 O14733 1/20 0.46

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
SCHEMBL5378060 0.90 AURKA (0.61) AURKAITKMAPK1TTKMAPK8
SCHEMBL5386918 0.88 TTK (0.56) AURKAITKMAPK1TTKMAPK8
SCHEMBL5379531 0.87 TTK (0.60) AURKATTKMAPK8ROCK2ROCK1
SCHEMBL6844212 0.85 TTK (0.53) AURKATTKMAPK8MAP2K7
SCHEMBL8260275 0.85 TTK (0.61) AURKAMAPK1TTKMAPK8
SCHEMBL5381231 0.85 AURKA (0.59) AURKANAMPTITKMAPK1TTK
SCHEMBL5387166 0.85 AURKA (0.63) AURKAITKTTKMAPK8MAP2K7
SCHEMBL8260259 0.84 TTK (0.52) AURKATTKMAPK8MAP2K7
SCHEMBL5378112 0.83 AURKA (0.52) AURKAMAPK1TTKMAPK8MAP2K7
SCHEMBL5800969 0.83 TTK (0.59) AURKANAMPTITKMAPK1TTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
US-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK SIGNAL PHARMACEUTICALS, LLC 2004-07-01 US claimed
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-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

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 3307/4885NAMPT 2663/4885ITK 1780/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT AURKA 2787/4885NAMPT 551/4885ITK 1770/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R AURKA 1439/4885NAMPT 514/4885ITK 54/4885

“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.