SCHEMBL5514698

SCHEMBL5514698

c1ccc(-c2n[nH]c3ccc(-c4cccnc4)cc23)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.72
IDO1 P14902 1/20 0.67
LRRK2 Q5S007 1/20 0.67
DYRK1A Q13627 7/20 0.66
CLK3 P49761 4/20 0.66
CLK2 P49760 4/20 0.66
PIM1 P11309 3/20 0.65
PIM3 Q86V86 1/20 0.65
PIM2 Q9P1W9 1/20 0.65
MAP2K4 P45985 1/20 0.64
WNT1 P04628 2/20 0.63
CDK7 P50613 1/20 0.62
DCLK1 O15075 1/20 0.58
PRKD3 O94806 1/20 0.58
MAP4K4 O95819 1/20 0.58
CHEK2 O96017 1/20 0.58
CSF1R P07333 1/20 0.58
FER P16591 1/20 0.58
CDK2 P24941 1/20 0.58
MARK3 P27448 1/20 0.58

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
SCHEMBL17306449 0.87 MKNK1 (0.87) MKNK1IDO1DYRK1ACLK2PIM1
SCHEMBL30588952 0.84 JAK2 (0.69) LRRK2DYRK1ACLK3CLK2PIM1
SCHEMBL29942349 0.84 MAP2K4 (0.64) MKNK1IDO1LRRK2DYRK1ACLK3
SCHEMBL10213963 0.84 JAK2 (0.69) LRRK2DYRK1ACLK3CLK2PIM1
SCHEMBL5508162 0.84 MKNK1 (1.00) MKNK1IDO1LRRK2DYRK1ACLK3
SCHEMBL760763 0.83 DYRK1A (0.65) MKNK1IDO1LRRK2DYRK1ACLK3
SCHEMBL18446560 0.83 CLK3 (0.82) IDO1LRRK2DYRK1ACLK3CLK2
SCHEMBL15869066 0.82 WNT1 (0.73) IDO1LRRK2DYRK1ACLK3CLK2
SCHEMBL30725847 0.80 IDO1 (1.00) IDO1LRRK2DYRK1ACLK3CLK2
SCHEMBL12318034 0.80 IDO1 (1.00) IDO1LRRK2DYRK1ACLK3CLK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (4 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-20050239855-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation CDK3, MKI67, ROCK1 MKNK1 107/4885IDO1 27/4885LRRK2 1078/4885
US-20020161022-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation CDK3, MKI67, ROCK1 MKNK1 107/4885IDO1 27/4885LRRK2 1078/4885
US-20030139463-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation CDK3, MKI67, ROCK1 MKNK1 107/4885IDO1 27/4885LRRK2 1078/4885
US-20060111322-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation MKI67, CCNI, CDK3 MKNK1 241/4885IDO1 21/4885LRRK2 2829/4885

“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.