SCHEMBL5386522

SCHEMBL5386522

CC(C)c1nnc(-c2ccc3[nH]nc(-c4ccc(F)cc4)c3c2)[nH]1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 2/20 0.42
CSNK1D P48730 1/20 0.42
WNT1 P04628 2/20 0.41
MAP2K4 P45985 10/20 0.40
MAPK1 P28482 6/20 0.40
MAPK6 Q16659 6/20 0.40
MAPKAPK3 Q16644 5/20 0.40
MAPKAPK2 P49137 4/20 0.40
MAPKAPK5 Q8IW41 2/20 0.40
MKNK1 Q9BUB5 1/20 0.40
MAPK13 O15264 1/20 0.39
GCGR P47871 1/20 0.39
MAPK12 P53778 1/20 0.39
MAPK11 Q15759 1/20 0.39
MAPK14 Q16539 1/20 0.39
ITK Q08881 1/20 0.39
DYRK1A Q13627 2/20 0.38
CLK2 P49760 1/20 0.38
CLK3 P49761 1/20 0.38

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
SCHEMBL5460520 0.90 MAP2K4 (0.41) NTRK1CSNK1DWNT1MAP2K4MAPK1
SCHEMBL5372431 0.83 MAP2K4 (0.46) NTRK1CSNK1DWNT1MAP2K4MAPK1
SCHEMBL5378377 0.82 CSNK1D (0.44) NTRK1CSNK1DWNT1MAP2K4MAPK1
SCHEMBL5397836 0.81 MAPK1 (0.41) NTRK1CSNK1DWNT1MAP2K4MAPK1
SCHEMBL5392359 0.81 MKNK1 (0.56) NTRK1CSNK1DWNT1MAP2K4MAPK1
SCHEMBL5386618 0.81 MKNK1 (0.56) NTRK1CSNK1DWNT1MAPK1MKNK1
SCHEMBL5386003 0.81 WNT1 (0.45) NTRK1CSNK1DWNT1MAP2K4MAPK1
SCHEMBL5387121 0.80 MAPK13 (0.49) NTRK1CSNK1DWNT1MAP2K4MAPK1
SCHEMBL5386011 0.80 MAPK13 (0.49) NTRK1CSNK1DWNT1MAP2K4MAPK1
SCHEMBL5383296 0.80 MAPK1 (0.55) NTRK1CSNK1DWNT1MAP2K4MAPK1

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-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
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 (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 NTRK1 2396/4885CSNK1D 349/4885WNT1 1359/4885
US-20040077877-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 NTRK1 1692/4885CSNK1D 164/4885WNT1 1195/4885
US-20050107457-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 NTRK1 1587/4885CSNK1D 245/4885WNT1 1340/4885
US-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 NTRK1 1692/4885CSNK1D 164/4885WNT1 1195/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R NTRK1 1046/4885CSNK1D 410/4885WNT1 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.