SCHEMBL4089701

SCHEMBL4089701

CCOC(=N)c1ccc2[nH]nc(-c3ccc4cc(OCCN5CCCC5=O)ccc4c3)c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
MAPK8 P45983 4/20 0.40
GAK O14976 1/20 0.40
DYRK3 O43781 1/20 0.40
JAK2 O60674 1/20 0.40
PRKD3 O94806 1/20 0.40
MAP4K4 O95819 1/20 0.40
NQO2 P16083 1/20 0.40
CSNK2A2 P19784 1/20 0.40
FECH P22830 1/20 0.40
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40
MAPK9 P45984 1/20 0.40
CSNK1A1 P48729 1/20 0.40
CSNK1D P48730 1/20 0.40
CSNK1E P49674 1/20 0.40
CLK1 P49759 1/20 0.40
CLK2 P49760 1/20 0.40
GSK3B P49841 1/20 0.40
JAK3 P52333 1/20 0.40

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
SCHEMBL4093823 0.88 LRRK2 (0.40) MAPK8GAKDYRK3JAK2PRKD3
SCHEMBL4039462 0.87 CLK2 (0.51) MAPK8GAKDYRK3JAK2PRKD3
SCHEMBL4084704 0.86 CLK2 (0.53) MAPK8GAKDYRK3JAK2PRKD3
SCHEMBL4089635 0.86 CLK2 (0.53) MAPK8GAKDYRK3JAK2PRKD3
Hydrochloric Acid SCHEMBL4083117 0.85 CLK2 (0.52) MAPK8GAKDYRK3JAK2PRKD3
Hydrochloric Acid SCHEMBL4085321 0.85 CLK2 (0.52) MAPK8GAKDYRK3JAK2PRKD3
SCHEMBL4083779 0.85 CLK2 (0.50) MAPK8GAKDYRK3JAK2PRKD3
Hydrochloric Acid SCHEMBL4084543 0.83 TTK (0.40) MAPK8GAKDYRK3JAK2PRKD3
SCHEMBL4084785 0.82 TTK (0.39) MAPK8GAKDYRK3JAK2PRKD3
SCHEMBL4090234 0.82 TTK (0.39) MAPK8GAKDYRK3JAK2PRKD3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2065383-A1 Indazole compounds and methods of use thereof as protein kinase inhibitors Signal Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 US disclosed
EP-1692128-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS Signal Pharmaceuticals LLC (US) 2006-08-23 EP disclosed
US-20060004043-A1 Indazole compounds and methods of use thereof BHAGWAT SHRIPAD S 2006-01-05 US disclosed
WO-2005051942-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2005-06-09 WO 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 (2 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-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF WNT3, WNT3A, WNK3 POLB 3400/4885MAPK8 213/4885GAK 387/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 POLB 3558/4885MAPK8 201/4885GAK 398/4885

“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.