SCHEMBL18197855

SCHEMBL18197855

COc1cnccc1-c1ccc2nnc(Cc3cccc(CCO)c3)n2n1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.45
MET P08581 11/20 0.44
FYN P06241 5/20 0.43
LRRK2 Q5S007 1/20 0.38

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
SCHEMBL2493568 0.76 MET (0.55) DYRK1AMETLRRK2
SCHEMBL19338457 0.70 MET (0.39) MET
SCHEMBL2268153 0.67 MET (0.73) METFYN
SCHEMBL12368875 0.67 MET (0.51) DYRK1AMETFYNLRRK2
SCHEMBL2698395 0.64 MET (0.64) MET
SCHEMBL12224256 0.63 MET (0.46) DYRK1AMETFYN
SCHEMBL1133726 0.63 MET (0.57) METFYNLRRK2
SCHEMBL1133771 0.63 MET (0.60) METFYNLRRK2
Hydrochloric Acid SCHEMBL2697873 0.63 MET (0.63) MET
SCHEMBL2495255 0.61 MET (1.00) METFYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966214-B1 TRIAZOLOPYRIDAZINES AS TYROSINE KINASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2016-11-02 EP disclosed