SCHEMBL3667340

SCHEMBL3667340

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

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 7/20 0.70
GSK3B P49841 5/20 0.70
PIM1 P11309 3/20 0.70
DYRK1A Q13627 5/20 0.59
ROCK1 Q13464 5/20 0.59
CLK4 Q9HAZ1 4/20 0.59
AURKA O14965 4/20 0.59
DAPK3 O43293 4/20 0.59
GSK3A P49840 4/20 0.59
CDK5 Q00535 4/20 0.59
JAK2 O60674 3/20 0.59
AURKB Q96GD4 3/20 0.59
CLK2 P49760 3/20 0.59
PRKACA P17612 3/20 0.59
FGFR1 P11362 2/20 0.59
KDR P35968 2/20 0.59
RPS6KA3 P51812 2/20 0.59
CHEK1 O14757 1/20 0.59
PRKD3 O94806 1/20 0.59
MAP4K4 O95819 1/20 0.59

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
SCHEMBL3636001 0.87 ROCK2 (0.71) ROCK2GSK3BPIM1DYRK1AROCK1
SCHEMBL3670768 0.85 FAAH (0.67) ROCK2GSK3BPIM1DYRK1AROCK1
SCHEMBL3667748 0.84 ALDH1A1 (0.68) ROCK2GSK3BPIM1DYRK1AROCK1
SCHEMBL3666993 0.84 ROCK2 (0.64) ROCK2GSK3BPIM1DYRK1AROCK1
SCHEMBL3666898 0.84 ROCK2 (0.67) ROCK2GSK3BPIM1DYRK1AROCK1
SCHEMBL3637194 0.84 LMNA (0.68) ROCK2GSK3BPIM1DYRK1AROCK1
SCHEMBL3634175 0.83 ROCK2 (0.62) ROCK2GSK3BPIM1DYRK1AROCK1
SCHEMBL3636595 0.83 ROCK2 (0.61) ROCK2GSK3BPIM1DYRK1AROCK1
SCHEMBL3670364 0.83 ROCK2 (0.67) ROCK2GSK3BPIM1DYRK1AROCK1
SCHEMBL3668427 0.82 ROCK2 (1.00) ROCK2GSK3BPIM1DYRK1AROCK1

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 ROCK2 48/4885GSK3B 1/4885PIM1 11/4885
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS GSK3B, GSK3A, PIM3 ROCK2 48/4885GSK3B 1/4885PIM1 11/4885

“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.