SCHEMBL5510153

SCHEMBL5510153

c1c[nH]c(-c2n[nH]c3ccc(-c4ccncc4)cc23)c1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.67
JAK2 O60674 2/20 0.57
CHEK1 O14757 2/20 0.50
DYRK1A Q13627 6/20 0.49
CLK2 P49760 5/20 0.49
CLK3 P49761 5/20 0.49
MAPKAPK2 P49137 1/20 0.48
AKT1 P31749 1/20 0.47
PDPK1 O15530 2/20 0.47
NTRK1 P04629 1/20 0.45
AXL P30530 1/20 0.44
LRRK2 Q5S007 1/20 0.44
TTK P33981 1/20 0.43
PDE3B Q13370 1/20 0.42
PDE3A Q14432 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
SCHEMBL760763 0.85 DYRK1A (0.65) MKNK1DYRK1ACLK2CLK3AKT1
SCHEMBL758691 0.82 AKT1 (0.52) MKNK1DYRK1ACLK2CLK3MAPKAPK2
SCHEMBL10214011 0.81 LRRK2 (0.52) MKNK1DYRK1ACLK2CLK3MAPKAPK2
SCHEMBL5508162 0.80 MKNK1 (1.00) MKNK1JAK2CHEK1DYRK1ACLK2
SCHEMBL758466 0.78 FLT3 (0.62) MKNK1JAK2DYRK1ACLK2MAPKAPK2
SCHEMBL5516155 0.78 MAPKAPK2 (0.57) MKNK1JAK2DYRK1ACLK2CLK3
SCHEMBL18487449 0.77 ITK (0.68) MKNK1JAK2CHEK1DYRK1ACLK2
SCHEMBL18446365 0.75 DYRK1A (0.59) MKNK1JAK2CHEK1DYRK1ACLK2
SCHEMBL18446575 0.75 DYRK1A (0.60) MKNK1JAK2CHEK1DYRK1ACLK2
SCHEMBL381383 0.75 IDO1 (0.58) MAPKAPK2PDPK1LRRK2TTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 US disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 US disclosed
US-7232912-B2 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS, INC. (US) 2007-06-19 US disclosed
US-7232912-B2 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS, INC. (US) 2007-06-19 US disclosed
US-7232912-B2 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS, INC. (US) 2007-06-19 US disclosed
US-20060111322-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS, INC. 2006-05-25 US disclosed
US-20050239855-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS, INC. 2005-10-27 US disclosed
US-6919461-B2 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS, INC. (US) 2005-07-19 US disclosed
US-20030139463-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation REICH SIEGFRIED HEINZ (US) 2003-07-24 US disclosed
US-6555539-B2 For treating cancer and other disease states associated with unwanted angiogenesis and/or cellular proliferation such as diabetic retinopathy, neovascular glaucoma, rheumatoid arthritis, psoriasis AGOURON PHARMACEUTICALS 2003-04-29 US disclosed
CN-1394205-A Indazole compounds, pharmaceutical compositions, and their use for mediating or inhibiting cell proliferation AGOURON PHARMA (US) 2003-01-29 CN disclosed
US-20020161022-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS 2002-10-31 US 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 (6 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-20070282101-A1 Indazole compounds CYP3A43, CYP3A7, UGT1A1 MKNK1 1629/4885JAK2 1822/4885CHEK1 1404/4885
US-20050239855-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation CDK3, MKI67, ROCK1 MKNK1 107/4885JAK2 359/4885CHEK1 369/4885
US-20020161022-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation CDK3, MKI67, ROCK1 MKNK1 107/4885JAK2 359/4885CHEK1 369/4885
US-20030139463-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation CDK3, MKI67, ROCK1 MKNK1 107/4885JAK2 359/4885CHEK1 369/4885
US-20060111322-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation MKI67, CCNI, CDK3 MKNK1 241/4885JAK2 443/4885CHEK1 142/4885
US-20120053345-A1 Indazole Compounds CYP3A43, CYP3A7, UGT1A1 MKNK1 1629/4885JAK2 1822/4885CHEK1 1404/4885

“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.