SCHEMBL5377563

SCHEMBL5377563

c1cncc(-c2n[nH]c3ccc(-c4nnc(CN5CCCC5)[nH]4)cc23)c1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 14/20 0.52
CLK2 P49760 8/20 0.52
CLK3 P49761 8/20 0.52
WNT1 P04628 9/20 0.51
CSNK1D P48730 1/20 0.50
MAP2K4 P45985 1/20 0.48
IDO1 P14902 1/20 0.46
LRRK2 Q5S007 1/20 0.46
TGFBR1 P36897 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
SCHEMBL5386655 0.83 CSNK1D (0.72) DYRK1ACLK2CLK3WNT1CSNK1D
SCHEMBL5381396 0.82 CSNK1D (0.48) DYRK1ACLK2CLK3WNT1CSNK1D
SCHEMBL5394703 0.81 CSNK1D (0.53) DYRK1ACLK2CLK3WNT1CSNK1D
SCHEMBL5388950 0.80 MAP2K4 (0.54) DYRK1ACLK2CLK3WNT1MAP2K4
SCHEMBL13876986 0.80 CSNK1D (0.61) DYRK1ACLK2CLK3WNT1CSNK1D
SCHEMBL13812056 0.80 CSNK1D (0.51) DYRK1ACLK2CLK3WNT1CSNK1D
SCHEMBL8257531 0.77 CSNK1D (0.44) DYRK1ACLK2CLK3WNT1CSNK1D
SCHEMBL5381928 0.76 CSNK1D (0.49) DYRK1AWNT1CSNK1D
SCHEMBL8256328 0.76 CSNK1D (0.44) DYRK1ACLK2CLK3WNT1CSNK1D
SCHEMBL5377200 0.74 NTRK1 (0.53) DYRK1ACLK2CLK3WNT1MAP2K4

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 DYRK1A 1188/4885CLK2 352/4885CLK3 527/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT DYRK1A 1932/4885CLK2 182/4885CLK3 226/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R DYRK1A 426/4885CLK2 398/4885CLK3 327/4885

“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.