SCHEMBL3668422

SCHEMBL3668422

O=C(c1cc(-c2ccc3[nH]ncc3c2)on1)N1CCCC1c1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCD O00767 12/20 0.70
SCD5 Q86SK9 10/20 0.70
ROCK2 O75116 3/20 0.64
CLK4 Q9HAZ1 3/20 0.64
STK17A Q9UEE5 3/20 0.64
RPS6KB1 P23443 2/20 0.64
CLK2 P49760 2/20 0.64
DYRK3 O43781 1/20 0.64
ROCK1 Q13464 1/20 0.64
MKNK2 Q9HBH9 1/20 0.64
CSNK1G1 Q9HCP0 1/20 0.64
DYRK1A Q13627 1/20 0.63

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
SCHEMBL3673041 0.97 SCD (0.66) SCDSCD5ROCK2CLK4STK17A
SCHEMBL3670699 0.87 SCD5 (0.66) SCDSCD5ROCK2CLK4STK17A
SCHEMBL3668953 0.86 ROCK2 (0.58) SCDSCD5ROCK2CLK4STK17A
SCHEMBL3673647 0.83 ROCK2 (0.72) SCDSCD5ROCK2CLK4STK17A
SCHEMBL21535917 0.83 SCD (1.00) SCDSCD5
SCHEMBL21536326 0.83 SCD (1.00) SCDSCD5
SCHEMBL21535920 0.83 SCD (1.00) SCDSCD5
SCHEMBL21535925 0.79 SCD (1.00) SCDSCD5
SCHEMBL21536529 0.79 SCD5 (1.00) SCDSCD5
SCHEMBL21536546 0.79 SCD (1.00) SCDSCD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 SCD 3947/4885SCD5 3059/4885ROCK2 48/4885
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS GSK3B, GSK3A, PIM3 SCD 3947/4885SCD5 3059/4885ROCK2 48/4885

“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.