SCHEMBL5398587

SCHEMBL5398587

c1cncc(-c2n[nH]c3ccc(-c4n[nH]c(CC5CC5)n4)cc23)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 1/20 0.51
IDO1 P14902 1/20 0.49
LRRK2 Q5S007 1/20 0.49
DYRK1A Q13627 10/20 0.48
CLK3 P49761 5/20 0.48
CLK2 P49760 4/20 0.48
CSNK1D P48730 1/20 0.47
ADORA2A P29274 1/20 0.47
WNT1 P04628 6/20 0.47
NTRK1 P04629 1/20 0.47
PIM1 P11309 1/20 0.45
AXL P30530 1/20 0.44
GSK3B P49841 1/20 0.44
KCNH2 Q12809 1/20 0.44

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
SCHEMBL5378119 0.86 CSNK1D (0.54) LRRK2CSNK1DADORA2ANTRK1
SCHEMBL5387116 0.83 CSNK1D (0.54) MAP2K4DYRK1ACLK3CLK2CSNK1D
SCHEMBL8435451 0.83 CSNK1D (0.47) MAP2K4LRRK2DYRK1ACSNK1DADORA2A
SCHEMBL5387177 0.83 CSNK1D (0.67) MAP2K4DYRK1ACLK3CLK2CSNK1D
SCHEMBL5379832 0.82 CSNK1D (0.58) MAP2K4IDO1LRRK2DYRK1ACLK3
SCHEMBL5386655 0.82 CSNK1D (0.72) MAP2K4IDO1LRRK2DYRK1ACLK3
SCHEMBL5378212 0.81 PDPK1 (0.52) MAP2K4LRRK2CSNK1DADORA2APIM1
SCHEMBL5378080 0.81 ADORA2A (0.49) LRRK2CSNK1DADORA2ANTRK1GSK3B
SCHEMBL5380485 0.81 CSNK1D (0.53) MAP2K4DYRK1ACSNK1DADORA2AWNT1
SCHEMBL5388496 0.80 ADORA2A (0.58) LRRK2DYRK1ACSNK1DADORA2AGSK3B

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 MAP2K4 130/4885IDO1 1250/4885LRRK2 231/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT MAP2K4 3021/4885IDO1 17/4885LRRK2 1898/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R MAP2K4 385/4885IDO1 145/4885LRRK2 280/4885

“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.