SCHEMBL4084573

SCHEMBL4084573

c1cnc2ccc(-c3n[nH]c4ccc(-c5nc(CN6CCOCC6)n[nH]5)cc34)cc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.45
LRRK2 Q5S007 7/20 0.43
DYRK1A Q13627 4/20 0.41
CLK2 P49760 3/20 0.41
CLK3 P49761 3/20 0.41
ATR Q13535 1/20 0.41
ATRIP Q8WXE1 1/20 0.41
CHEK1 O14757 1/20 0.40
CDK7 P50613 1/20 0.40
PIK3CA P42336 1/20 0.39
MTOR P42345 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
WNT1 P04628 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
FGFR1 P11362 1/20 0.38
FLT1 P17948 1/20 0.38
GRM4 Q14833 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
SCHEMBL13812167 0.81 FGFR1 (0.48) JAK2LRRK2DYRK1ACLK2CHEK1
SCHEMBL17801015 0.80 LRRK2 (0.52) JAK2LRRK2CHEK1CDK7
SCHEMBL4085294 0.80 CLK2 (0.41) JAK2LRRK2DYRK1ACLK2CLK3
SCHEMBL4169696 0.74 CSNK1D (0.47) JAK2DYRK1ACLK2CLK3CHEK1
SCHEMBL13876985 0.74 CSNK1D (0.47) JAK2DYRK1ACLK2CLK3CHEK1
SCHEMBL4084821 0.74 CSNK1D (0.57) JAK2DYRK1ACLK2CLK3WNT1
SCHEMBL2872738 0.73 JAK2 (0.57) JAK2LRRK2CHEK1CDK7ALDH1A1
SCHEMBL13811900 0.73 FGFR1 (0.52) JAK2DYRK1ACLK2CLK3WNT1
SCHEMBL4084647 0.72 CLK2 (0.46) JAK2LRRK2DYRK1ACLK2CLK3
SCHEMBL4084381 0.72 GSK3B (0.46) LRRK2ALDH1A1

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 7 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
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 US 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 JAK2 327/4885LRRK2 553/4885DYRK1A 461/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 JAK2 270/4885LRRK2 563/4885DYRK1A 354/4885

“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.