SCHEMBL4089678

SCHEMBL4089678

CCOC(=N)c1ccc2[nH]nc(-c3ccc4cc(OCCc5ccccn5)ccc4c3)c2c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TTK P33981 6/20 0.45
MAPK8 P45983 4/20 0.43
PPARG P37231 1/20 0.40
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
MAPK1 P28482 4/20 0.39
FGFR4 P22455 1/20 0.38
FGFR1 P11362 1/20 0.37
FLT3 P36888 1/20 0.36
CHEK1 O14757 1/20 0.36
CSNK1D P48730 1/20 0.35
MAPKAPK2 P49137 1/20 0.35
TLR9 Q9NR96 1/20 0.34
TLR8 Q9NR97 1/20 0.34
TLR7 Q9NYK1 1/20 0.34

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
SCHEMBL4050943 0.91 TTK (0.47) TTKMAPK8PPARGMAPK1FGFR4
SCHEMBL4170396 0.84 CYP19A1 (0.42) TTKMAPK8MAPK1FGFR4FGFR1
SCHEMBL4084769 0.84 TTK (0.48) TTKMAPK8MAPK1CSNK1DMAPKAPK2
SCHEMBL4079832 0.83 TTK (0.43) TTKMAPK8MAPK1FLT3MAPKAPK2
SCHEMBL4089601 0.83 BRAF (0.44) TTKMAPK8FLT3
SCHEMBL4043448 0.82 BTK (0.45) TTKMAPK8MAPK1FLT3MAPKAPK2
Hydrochloric Acid SCHEMBL4083323 0.81 BTK (0.44) TTKMAPK8MAPK1FLT3MAPKAPK2
Hydrochloric Acid SCHEMBL5397824 0.81 BTK (0.44) TTKMAPK8MAPK1FLT3MAPKAPK2
SCHEMBL4083120 0.80 TTK (0.41) TTKMAPK8PDE3BPDE3AFLT3
SCHEMBL4039462 0.80 CLK2 (0.51) TTKMAPK8FGFR1FLT3CSNK1D

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 TTK 401/4885MAPK8 213/4885PPARG 1133/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 TTK 377/4885MAPK8 201/4885PPARG 1113/4885

“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.