SCHEMBL4083890

SCHEMBL4083890

CCOc1ccc2cc(-c3n[nH]c4ccc(C(N)=O)cc34)ccc2c1

nearest known ligand 0.74

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TTK P33981 5/20 0.74
MAPK8 P45983 4/20 0.74
MAP2K4 P45985 4/20 0.54
MAPK1 P28482 2/20 0.54
MAPKAPK3 Q16644 2/20 0.54
MAPK6 Q16659 2/20 0.54
MAPKAPK2 P49137 1/20 0.54
MAPKAPK5 Q8IW41 1/20 0.54
CHEK2 O96017 1/20 0.53
SRC P12931 4/20 0.49
PARP10 Q53GL7 1/20 0.47
KCNH2 Q12809 2/20 0.46
LRRK2 Q5S007 1/20 0.44
FGFR2 P21802 1/20 0.43
FGFR3 P22607 1/20 0.43
MAP3K5 Q99683 1/20 0.43
BTK Q06187 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL4080050 0.91 TTK (0.62) TTKMAPK8MAP2K4MAPK1MAPKAPK3
SCHEMBL5802211 0.91 TTK (0.73) TTKMAPK8MAP2K4MAPK1MAPKAPK3
SCHEMBL5372669 0.87 MAP2K4 (0.57) TTKMAPK8MAP2K4MAPK1MAPKAPK3
SCHEMBL5374570 0.82 MAP2K4 (0.59) TTKMAPK8MAP2K4MAPK1MAPKAPK3
SCHEMBL4171537 0.80 TTK (0.50) TTKMAPK8MAP2K4MAPK1MAPKAPK3
SCHEMBL4171533 0.80 TTK (0.50) TTKMAPK8MAP2K4MAPK1MAPKAPK3
SCHEMBL5424602 0.80 TTK (0.64) TTKMAPK8MAP2K4MAPK1MAPKAPK3
SCHEMBL5372947 0.80 MAP2K4 (0.66) TTKMAPK8MAP2K4MAPK1MAPKAPK3
SCHEMBL4084888 0.80 TTK (0.57) TTKMAPK8LRRK2FGFR2FGFR3
SCHEMBL4085367 0.77 TTK (0.57) TTKMAPK8LRRK2FGFR2FGFR3

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 213/4885MAP2K4 358/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 TTK 377/4885MAPK8 201/4885MAP2K4 357/4885

“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.