SCHEMBL5378060

SCHEMBL5378060

O=C(Nc1ccccc1)Nc1cccc(-c2n[nH]c3ccc(-c4nc[nH]n4)cc23)c1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AURKA O14965 12/20 0.61
TTK P33981 2/20 0.58
MAPK8 P45983 1/20 0.52
NTRK1 P04629 1/20 0.50
MAP3K5 Q99683 1/20 0.49
MAP2K7 O14733 1/20 0.49
MAPK1 P28482 2/20 0.48
ITK Q08881 1/20 0.47
AURKB Q96GD4 4/20 0.46
IGF1R P08069 1/20 0.45
RIPK1 Q13546 1/20 0.45
MAP2K4 P45985 1/20 0.45
MAPKAPK3 Q16644 1/20 0.45
MAPK6 Q16659 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
SCHEMBL6844212 0.92 TTK (0.53) AURKATTKMAPK8MAP3K5MAP2K7
SCHEMBL5387166 0.91 AURKA (0.63) AURKATTKMAPK8NTRK1MAP3K5
SCHEMBL8260259 0.90 TTK (0.52) AURKATTKMAPK8MAP3K5MAP2K7
SCHEMBL5387657 0.90 AURKA (0.54) AURKATTKMAPK8MAP2K7MAPK1
SCHEMBL5378112 0.89 AURKA (0.52) AURKATTKMAPK8NTRK1MAP3K5
SCHEMBL8254966 0.89 AURKA (0.56) AURKATTKMAPK8NTRK1MAP3K5
SCHEMBL5379582 0.88 TTK (0.66) AURKATTKMAPK8MAP3K5MAP2K7
SCHEMBL5386918 0.88 TTK (0.56) AURKATTKMAPK8MAP3K5MAP2K7
SCHEMBL5379531 0.87 TTK (0.60) AURKATTKMAPK8AURKB
SCHEMBL5382414 0.87 AURKA (0.52) AURKATTKMAPK8MAP3K5MAP2K7

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 3307/4885TTK 1198/4885MAPK8 26/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT AURKA 2787/4885TTK 2139/4885MAPK8 3017/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R AURKA 1439/4885TTK 714/4885MAPK8 91/4885

“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.