SCHEMBL5377752

SCHEMBL5377752

CN(C)Cc1nc(-c2ccc3[nH]nc(-c4cccc(N(C=O)Cc5ccc(F)cc5)c4)c3c2)n[nH]1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 2/20 0.64
DYRK1A Q13627 6/20 0.41
CLK2 P49760 4/20 0.41
CLK3 P49761 4/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.39
WNT1 P04628 3/20 0.38
TTK P33981 2/20 0.37
NTRK1 P04629 2/20 0.35
LRRK2 Q5S007 1/20 0.35
ALOX5 P09917 1/20 0.35
ADORA2A P29274 1/20 0.34
MAPK1 P28482 1/20 0.34
MAP2K4 P45985 1/20 0.34
MAPK8 P45983 1/20 0.34

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
SCHEMBL5375279 0.85 CSNK1D (0.55) CSNK1DDYRK1ACLK2CLK3WNT1
SCHEMBL5375455 0.80 CSNK1D (0.43) CSNK1DPTGDR2ADORA2A
SCHEMBL8252413 0.80 CSNK1D (0.79) CSNK1DDYRK1ATTKMAPK1
SCHEMBL5375066 0.79 MAP3K5 (0.47) CSNK1DDYRK1ACLK2CLK3PTGDR2
SCHEMBL5377759 0.77 CSNK1D (0.67) CSNK1DDYRK1ACLK2CLK3WNT1
SCHEMBL5379434 0.75 CSNK1D (0.62) CSNK1DWNT1TTKNTRK1MAPK1
SCHEMBL7195374 0.74 CSNK1D (0.45) CSNK1DDYRK1ACLK2CLK3TTK
SCHEMBL5379832 0.74 CSNK1D (0.58) CSNK1DDYRK1ACLK2CLK3WNT1
SCHEMBL5380035 0.74 NTRK1 (0.47) CSNK1DNTRK1LRRK2ALOX5MAPK1
SCHEMBL5373431 0.73 CSNK1D (0.68) CSNK1DWNT1TTKNTRK1MAPK1

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-6897231-B2 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, INC. (US) 2005-05-24 US claimed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 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 CSNK1D 349/4885DYRK1A 1188/4885CLK2 352/4885
US-20040077877-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 CSNK1D 164/4885DYRK1A 784/4885CLK2 322/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT CSNK1D 1173/4885DYRK1A 1932/4885CLK2 182/4885
US-20050107457-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 CSNK1D 245/4885DYRK1A 726/4885CLK2 303/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R CSNK1D 410/4885DYRK1A 426/4885CLK2 398/4885

“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.