SCHEMBL4089601

SCHEMBL4089601

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

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 8/20 0.44
TTK P33981 5/20 0.43
MAPK8 P45983 4/20 0.43
ACHE P22303 2/20 0.41
WNT1 P04628 1/20 0.40
MAOA P21397 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
FLT3 P36888 1/20 0.39
NUAK1 O60285 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
SCHEMBL4079832 0.86 TTK (0.43) TTKMAPK8FLT3
SCHEMBL4043448 0.85 BTK (0.45) TTKMAPK8KDM4EALDH1A1FLT3
Hydrochloric Acid SCHEMBL4083323 0.84 BTK (0.44) TTKMAPK8KDM4EALDH1A1FLT3
Hydrochloric Acid SCHEMBL5397824 0.84 BTK (0.44) TTKMAPK8KDM4EALDH1A1FLT3
SCHEMBL4083120 0.83 TTK (0.41) TTKMAPK8FLT3
SCHEMBL4089678 0.83 TTK (0.45) TTKMAPK8FLT3
SCHEMBL4039462 0.83 CLK2 (0.51) TTKMAPK8ACHEWNT1FLT3
SCHEMBL4083929 0.83 BTK (0.43) TTKMAPK8KDM4EALDH1A1FLT3
SCHEMBL4084704 0.83 CLK2 (0.53) MAPK8ACHEFLT3NUAK1
SCHEMBL4089635 0.83 CLK2 (0.53) MAPK8ACHEFLT3NUAK1

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 BRAF 106/4885TTK 401/4885MAPK8 213/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 BRAF 99/4885TTK 377/4885MAPK8 201/4885

“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.