SCHEMBL3669980

SCHEMBL3669980

Nc1n[nH]c2ccc(-c3nnn(Cc4ccc(C(F)(F)F)cc4)c3-c3ccc(F)cc3)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 20/20 1.00
MAP4K4 O95819 10/20 0.79
PRKACA P17612 10/20 0.79
GSK3B P49841 10/20 0.79
CDK2 P24941 9/20 0.79
ROCK2 O75116 8/20 0.79
CLK4 Q9HAZ1 8/20 0.79
DAPK3 O43293 7/20 0.79
PRKD3 O94806 7/20 0.79
CLK2 P49760 7/20 0.79
PRKX P51817 7/20 0.79
JAK3 P52333 7/20 0.79
CDK5 Q00535 7/20 0.79
MAP4K2 Q12851 7/20 0.79
DYRK1A Q13627 7/20 0.79
MKNK2 Q9HBH9 7/20 0.79
GSK3A P49840 6/20 0.79
ROCK1 Q13464 6/20 0.79
AURKB Q96GD4 6/20 0.79
CAMK2D Q13557 6/20 0.79

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
SCHEMBL3666010 0.88 CDC7 (1.00) CDC7MAP4K4PRKACAGSK3BCDK2
SCHEMBL4285130 0.81 CDC7 (1.00) CDC7MAP4K4PRKACAGSK3BCDK2
SCHEMBL4298368 0.77 CDC7 (0.80) CDC7MAP4K4PRKACAGSK3BCDK2
SCHEMBL27788184 0.77 CDC7 (0.81) CDC7MAP4K4PRKACAGSK3BCDK2
SCHEMBL3640551 0.76 CDC7 (1.00) CDC7MAP4K4PRKACAGSK3BCDK2
SCHEMBL3667857 0.76 CDC7 (0.83) CDC7MAP4K4PRKACAGSK3BCDK2
SCHEMBL3670915 0.75 CDC7 (0.60) CDC7MAP4K4PRKACAGSK3BCDK2
SCHEMBL3667807 0.74 CDC7 (0.80) CDC7MAP4K4PRKACAGSK3BCDK2
Tert-Butyl Formate SCHEMBL27788238 0.74 CDC7 (0.79) CDC7MAP4K4PRKACAGSK3BCDK2
SCHEMBL3672020 0.74 CDC7 (0.83) CDC7MAP4K4PRKACAGSK3BCDK2

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
US-20140343066-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS AbbVie Deutschland GmbH & Co. KG (DE) 2014-11-20 US claimed
US-8648069-B2 5-substituted indazoles as kinase inhibitors ABBVIE INC. (US) 2014-02-11 US claimed
CN-101790526-A 5-heteroaryl substituted indazoles as kinase inhibitors ABBOTT GMBH & CO KG 2010-07-28 CN claimed
EP-2167491-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS Abbott Laboratories (US) 2010-03-31 EP claimed
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2009-08-13 US claimed
WO-2008154241-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2008-12-18 WO claimed
US-9163007-B2 5-substituted indazoles as kinase inhibitors ABBVIE INC. (US) 2015-10-20 US disclosed
US-20140343066-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS AbbVie Deutschland GmbH & Co. KG (DE) 2014-11-20 US disclosed
US-8648069-B2 5-substituted indazoles as kinase inhibitors ABBVIE INC. (US) 2014-02-11 US disclosed
CN-101790526-A 5-heteroaryl substituted indazoles as kinase inhibitors ABBOTT GMBH & CO KG 2010-07-28 CN disclosed
EP-2167491-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS Abbott Laboratories (US) 2010-03-31 EP disclosed
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2009-08-13 US disclosed
WO-2008154241-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2008-12-18 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-20140343066-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS GSK3B, GSK3A, PIM3 CDC7 8/4885MAP4K4 51/4885PRKACA 178/4885
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS GSK3B, GSK3A, PIM3 CDC7 8/4885MAP4K4 51/4885PRKACA 178/4885

“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.