SCHEMBL5389028

SCHEMBL5389028

O=c1[nH]nc(-c2ccc3[nH]nc(-c4ccc(F)cc4)c3c2)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 1/20 0.46
MKNK1 Q9BUB5 1/20 0.44
WNT1 P04628 1/20 0.44
MAP2K4 P45985 10/20 0.44
MAPK1 P28482 6/20 0.44
MAPK6 Q16659 5/20 0.44
NTRK1 P04629 2/20 0.43
MAP2K7 O14733 1/20 0.43
ITK Q08881 1/20 0.43
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
BTK Q06187 2/20 0.42
MAPKAPK3 Q16644 4/20 0.42
MAPKAPK2 P49137 2/20 0.42
MAPKAPK5 Q8IW41 1/20 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
SCHEMBL17801044 0.82 LRRK2 (0.52) MKNK1ITK
SCHEMBL5377210 0.81 ALOX5 (0.57) CSNK1DMKNK1WNT1MAP2K4MAPK1
SCHEMBL599945 0.80 MAP3K5 (0.50) CSNK1DMKNK1WNT1MAP2K4MAPK1
SCHEMBL16060197 0.79 BTK (0.64) BTK
SCHEMBL5372431 0.78 MAP2K4 (0.46) CSNK1DMKNK1WNT1MAP2K4MAPK1
SCHEMBL5386003 0.78 WNT1 (0.45) CSNK1DMKNK1WNT1MAP2K4MAPK1
SCHEMBL5392359 0.78 MKNK1 (0.56) CSNK1DMKNK1WNT1MAP2K4MAPK1
SCHEMBL5386618 0.78 MKNK1 (0.56) CSNK1DMKNK1WNT1MAPK1NTRK1
SCHEMBL17801062 0.78 BTK (0.50) CSNK1DMKNK1BTK
SCHEMBL5377574 0.77 CSNK1D (0.46) CSNK1DMKNK1WNT1MAP2K4MAPK1

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-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
EP-1618093-A2 INDAZOLE DERIVATIVES AS JNK INHIBITORS Signal Pharmaceuticals LLC (US) 2006-01-25 EP claimed
WO-2004094388-A2 INDAZOLE DERIVATIVES AS JNK INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2004-11-04 WO 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 CSNK1D 349/4885MKNK1 66/4885WNT1 1359/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT CSNK1D 1173/4885MKNK1 2029/4885WNT1 1364/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R CSNK1D 410/4885MKNK1 65/4885WNT1 255/4885

“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.