SCHEMBL5381471

SCHEMBL5381471

O=CN(OCc1ccccc1)c1ccc2[nH]nc(-c3ccc(F)cc3)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 5/20 0.41
CDK2 P24941 5/20 0.41
MAP4K4 O95819 3/20 0.41
CLK4 Q9HAZ1 3/20 0.41
MKNK2 Q9HBH9 3/20 0.41
PRKD3 O94806 2/20 0.41
CSF1R P07333 2/20 0.41
MARK3 P27448 2/20 0.41
FLT3 P36888 2/20 0.41
CLK2 P49760 2/20 0.41
CSNK2A1 P68400 2/20 0.41
CSNK1G2 P78368 2/20 0.41
MAP4K2 Q12851 2/20 0.41
CAMK2B Q13554 2/20 0.41
CAMK2G Q13555 2/20 0.41
DYRK1A Q13627 2/20 0.41
MELK Q14680 2/20 0.41
MINK1 Q8N4C8 2/20 0.41
BRSK1 Q8TDC3 2/20 0.41
AURKB Q96GD4 2/20 0.41

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
SCHEMBL5376638 0.75 LRRK2 (0.44) NTRK1MAP2K4CSNK1DNTRK3MAPK1
SCHEMBL5372291 0.73 MAP2K4 (0.42) NTRK1AURKBMAP2K4CSNK1DMAPK1
SCHEMBL5374860 0.73 NTRK1 (0.42) NTRK1CDK2MAP4K4CLK4MKNK2
SCHEMBL5380035 0.73 NTRK1 (0.47) NTRK1MAP2K4CSNK1DMAPK1MAPK3
SCHEMBL8260161 0.73 MAPK1 (0.57) CDK2MAP4K4PRKD3FLT3CLK2
SCHEMBL5377517 0.73 NTRK1 (0.42) NTRK1MAP2K4CSNK1DNTRK3MAPK1
SCHEMBL5378102 0.73 MAP2K4 (0.41) NTRK1MAP2K4CSNK1DMAPK1TTK
SCHEMBL5372830 0.72 NTRK1 (0.44) NTRK1MAP2K4CSNK1DMAPK1TTK
SCHEMBL5379787 0.72 NTRK1 (0.56) NTRK1CDK2MAP4K4CLK4MKNK2
SCHEMBL5382060 0.72 NTRK1 (0.45) NTRK1MAP2K4CSNK1DMAPK1MAPK3

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 12 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
WO-2002010137-A9 INDAZOLE DERIVATIVES AS JNK INHIBITORS SIGNAL PHARM INC (US) 2003-02-06 WO 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 NTRK1 2396/4885CDK2 565/4885MAP4K4 65/4885
US-20040077877-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 NTRK1 1692/4885CDK2 122/4885MAP4K4 41/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT NTRK1 4786/4885CDK2 2872/4885MAP4K4 3794/4885
US-20050107457-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 NTRK1 1587/4885CDK2 83/4885MAP4K4 38/4885
US-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 NTRK1 1692/4885CDK2 122/4885MAP4K4 41/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R NTRK1 1046/4885CDK2 365/4885MAP4K4 178/4885

“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.