SCHEMBL5249796

SCHEMBL5249796

O=C(O)c1ccccc1Nc1ccc2cnn(C=Cc3ccccn3)c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 9/20 0.42
PIM1 P11309 6/20 0.42
CDK2 P24941 6/20 0.42
HIPK2 Q9H2X6 6/20 0.42
CLK4 Q9HAZ1 6/20 0.42
MAP4K4 O95819 5/20 0.42
DAPK3 O43293 5/20 0.42
PRKD3 O94806 5/20 0.42
PRKACA P17612 5/20 0.42
FLT3 P36888 5/20 0.42
CSNK1A1 P48729 5/20 0.42
CLK2 P49760 5/20 0.42
JAK3 P52333 5/20 0.42
CDK5 Q00535 5/20 0.42
MAP4K2 Q12851 5/20 0.42
DYRK1A Q13627 5/20 0.42
STK17A Q9UEE5 5/20 0.42
PAK4 O96013 4/20 0.42
SYK P43405 4/20 0.42
STK3 Q13188 4/20 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
SCHEMBL5252321 0.89 KDR (0.44) MAPK8CDK2MAP4K4FLT3JAK3
SCHEMBL5254650 0.84 KDR (0.61) MAPK8KDRINSRMETFGFR1
SCHEMBL5247233 0.79 KDR (0.44) MAPK8CDK2MAP4K4FLT3JAK3
SCHEMBL5250145 0.78 FGFR1 (0.43) MAPK8CDK2FLT3SYKCDK9
SCHEMBL7554927 0.77 KDR (0.44) KDRMAPK13LCKFGFR1MAPK12
SCHEMBL5248923 0.73 KDR (0.58) MAPK8CDK2MAP4K4FLT3JAK3
SCHEMBL5248795 0.73 KDR (0.53) SYKKDREGFRINSRLCK
SCHEMBL7553518 0.72 KDR (0.41) CDK2DYRK1ASYKKDREGFR
SCHEMBL5252843 0.72 FGFR1 (0.54) SYKKDRFGFR1FLT1KIT
SCHEMBL5254045 0.72 KDR (0.43) MAPK8CDK2MAP4K4FLT3JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1614683-B1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMA (US) 2007-11-21 EP disclosed
EP-1218348-B1 INDAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PROTEIN KINASES, AND METHODS FOR THEIR USE AGOURON PHARMA (US) 2007-10-24 EP disclosed
US-7141587-B2 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2006-11-28 US disclosed
EP-1614683-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2006-01-11 EP disclosed
US-20050124662-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS. INC. 2005-06-09 US disclosed
US-6891044-B2 Indazole compounds and pharmaceutical compositions for Inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2005-05-10 US disclosed
US-6884890-B2 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2005-04-26 US disclosed
US-20040220248-A1 INDAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PROTEIN KINASES, AND METHODS FOR THEIR USE KANIA ROBERT STEVEN (US) 2004-11-04 US disclosed
US-20040171634-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, LLC 2004-09-02 US disclosed
US-6534524-B1 Antiproliferative agents, including axitinib AGOURON PHARMACEUTICALS, INC. 2003-03-18 US disclosed
US-6531491-B1 Methods of treating cancer and other disease states associated with unwanted angiogenesis and/or cellular proliferation, such as diabetic retinopathy, neovascular glaucoma, rheumatoid arthritis, and psoriasis, AGOURON PHARAMACEUTICALS, INC. 2003-03-11 US disclosed
EP-1218348-A2 INDAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PROTEIN KINASES, AND METHODS FOR THEIR USE AGOURON PHARMACEUTICALS, INC. (US) 2002-07-03 EP disclosed
WO-2001002369-A2 INDAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PROTEIN KINASES, AND METHODS FOR THEIR USE AGOURON PHARMACEUTICALS, INC. (US) 2001-01-11 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 (3 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-20040171634-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use CDK3, BRAF, ROCK1 MAPK8 213/4885PIM1 223/4885CDK2 9/4885
US-20050124662-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use CDK3, BRAF, ROCK1 MAPK8 213/4885PIM1 223/4885CDK2 9/4885
US-20040220248-A1 INDAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PROTEIN KINASES, AND METHODS FOR THEIR USE CDK3, BRAF, ROCK1 MAPK8 213/4885PIM1 223/4885CDK2 9/4885

“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.