SCHEMBL5377629

SCHEMBL5377629

CCC(CCc1nnc(-c2ccc3[nH]nc(-c4ccc(F)cc4)c3c2)[nH]1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 11/20 0.39
MAP2K4 P45985 5/20 0.39
MAPK6 Q16659 4/20 0.39
MAPKAPK3 Q16644 3/20 0.39
CSNK1D P48730 2/20 0.39
CLK2 P49760 2/20 0.38
CLK3 P49761 2/20 0.38
DYRK1A Q13627 2/20 0.38
NTRK1 P04629 1/20 0.37
WNT1 P04628 1/20 0.36
MAPKAPK2 P49137 1/20 0.36
MAPKAPK5 Q8IW41 1/20 0.36
FLT3 P36888 1/20 0.36
TTK P33981 1/20 0.36
MAPK8 P45983 1/20 0.36

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
SCHEMBL5388481 0.83 MAP2K4 (0.44) MAPK1MAP2K4MAPK6MAPKAPK3CSNK1D
SCHEMBL5383170 0.82 CSNK1D (0.46) MAPK1MAP2K4MAPK6MAPKAPK3CSNK1D
SCHEMBL5397836 0.81 MAPK1 (0.41) MAPK1MAP2K4MAPK6MAPKAPK3CSNK1D
SCHEMBL5375559 0.80 MAP2K4 (0.45) MAPK1MAP2K4MAPK6MAPKAPK3CSNK1D
SCHEMBL5383182 0.80 MAPT (0.42) MAPK1MAP2K4MAPK6MAPKAPK3CSNK1D
SCHEMBL8259388 0.79 MAP2K4 (0.45) MAPK1MAP2K4CSNK1DCLK2CLK3
SCHEMBL5378377 0.78 CSNK1D (0.44) MAPK1MAP2K4MAPK6MAPKAPK3CSNK1D
SCHEMBL8252227 0.78 FAAH (0.42) MAPK1MAP2K4MAPK6MAPKAPK3CSNK1D
SCHEMBL5397842 0.77 ALOX5 (0.42) MAPK1MAP2K4MAPK6MAPKAPK3CSNK1D
SCHEMBL8267978 0.77 MAP2K4 (0.43) MAPK1MAP2K4CSNK1DCLK2CLK3

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-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-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-6897231-B2 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, INC. (US) 2005-05-24 US disclosed
US-20050107457-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SINGNAL PHARMACEUTICALS, INC. 2005-05-19 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-20040077877-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, INC. 2004-04-22 US disclosed
US-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, LLC 2002-08-01 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 (6 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 MAPK1 1/4885MAP2K4 130/4885MAPK6 31/4885
US-20040077877-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 MAPK1 16/4885MAP2K4 71/4885MAPK6 31/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT MAPK1 2816/4885MAP2K4 3021/4885MAPK6 3602/4885
US-20050107457-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 MAPK1 22/4885MAP2K4 58/4885MAPK6 33/4885
US-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 MAPK1 16/4885MAP2K4 71/4885MAPK6 31/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R MAPK1 52/4885MAP2K4 385/4885MAPK6 122/4885

“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.