SCHEMBL3931379

SCHEMBL3931379

[c]1cc2cncnc2nn1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.33

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
SCHEMBL4431376 0.73 EGFR (0.41) EGFR
SCHEMBL29809882 0.69 EGFR (0.46) EGFR
SCHEMBL140301 0.69 EGFR (0.46) EGFR
SCHEMBL3934228 0.68 EGFR (0.34) EGFR
SCHEMBL3940815 0.68 EGFR (0.34) EGFR
SCHEMBL3941253 0.68
SCHEMBL30826363 0.65 EGFR (0.35) EGFR
SCHEMBL16878170 0.65 EGFR (0.35) EGFR
SCHEMBL3933222 0.64 EGFR (0.43) EGFR
SCHEMBL3934678 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009010156-A2 SUBSTITUTED PHENYLPROPOARGYL COMPOUNDS, METHODS FOR THE PRODUCTION THEREOF, AND USE OF SAME AS HERBICIDES AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2009-01-22 WO disclosed
EP-2017264-A1 Substituted phenyl propargyl compounds, method for their manufacture and their use as herbicides and plant growth regulators BAYER CROPSCIENCE AG (DE) 2009-01-21 EP disclosed