SCHEMBL8258720

SCHEMBL8258720

CC(C)NC(=O)c1cccc(-c2n[nH]c3ccc(-c4nc[nH]n4)cc23)c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.52
DYRK1A Q13627 2/20 0.51
MAP3K5 Q99683 3/20 0.50
MAPK1 P28482 7/20 0.49
MAPK3 P27361 2/20 0.49
TTK P33981 1/20 0.48
MAPK8 P45983 1/20 0.48
MAP2K4 P45985 1/20 0.48
CSNK1D P48730 2/20 0.48
ROCK2 O75116 2/20 0.47
ROCK1 Q13464 2/20 0.47
PRKD1 Q15139 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
SCHEMBL5378125 0.89 CSNK1D (0.56) LRRK2MAP3K5MAPK1TTKMAPK8
SCHEMBL17801052 0.87 TTK (0.53) LRRK2MAP3K5MAPK1MAPK3TTK
SCHEMBL5145706 0.87 JAK2 (0.52) LRRK2DYRK1AMAP3K5MAPK1TTK
SCHEMBL5375633 0.85 MAP3K5 (0.54) MAP3K5MAPK1MAPK3TTKMAPK8
SCHEMBL5372266 0.85 MAP2K4 (0.63) MAP3K5MAPK1TTKMAPK8MAP2K4
SCHEMBL8254966 0.84 AURKA (0.56) DYRK1AMAP3K5MAPK1TTKMAPK8
SCHEMBL5380225 0.84 CSNK1D (0.56) LRRK2DYRK1AMAP3K5TTKMAPK8
SCHEMBL8258727 0.84 MAP3K5 (0.57) LRRK2DYRK1AMAP3K5MAPK8
SCHEMBL8257261 0.84 MAP3K5 (0.65) LRRK2MAP3K5MAPK1MAPK3TTK
SCHEMBL8258782 0.84 MAP3K5 (0.57) LRRK2DYRK1AMAP3K5

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-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

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 LRRK2 231/4885DYRK1A 1188/4885MAP3K5 7/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT LRRK2 1898/4885DYRK1A 1932/4885MAP3K5 2520/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R LRRK2 280/4885DYRK1A 426/4885MAP3K5 32/4885

“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.