SCHEMBL6903439

SCHEMBL6903439

CN1C(=O)NCCC1C(=O)Nc1c(Cl)ccc(C(=O)C2C(=O)CCCC2=O)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 13/20 0.35

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
SCHEMBL6558204 0.90 P2RX7 (0.45) P2RX7
SCHEMBL2902825 0.77 HPD (0.36)
SCHEMBL2905370 0.72 DRD1 (0.31)
SCHEMBL6448378 0.71 DRD1 (0.30)
SCHEMBL6449902 0.70 ITGB1 (0.33)
SCHEMBL6449853 0.70 PKM (0.41)
SCHEMBL6447196 0.70 MAPT (0.42)
SCHEMBL10376030 0.68 HPD (0.42)
SCHEMBL6331254 0.65 HPD (0.32)
SCHEMBL2904657 0.62 LMNA (0.33)

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
EP-1423009-A2 HERBICIDES MADE FROM SUBSTITUTED ARYL KETONES Bayer CropScience AG (DE) 2004-06-02 EP disclosed
WO-2003017766-A2 HERBICIDES MADE FROM SUBSTITUTED ARYL KETONES BAYER CROPSCIENCE AG (DE) 2003-03-06 WO disclosed