SCHEMBL5771856

SCHEMBL5771856

COC(=O)O[C@]1(N)CC[C@H](C)CC1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
ALOX15 P16050 1/20 0.31

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
SCHEMBL6592094 1.00 POLB (0.33) POLBALOX15
Hydrochloric Acid SCHEMBL5756872 0.98 POLB (0.32) POLBALOX15
SCHEMBL7595256 0.83
SCHEMBL3823014 0.83 EPHX2 (0.33) ALOX15
Hydrochloric Acid SCHEMBL9033761 0.81 NPSR1 (0.30)
Hydrochloric Acid SCHEMBL27649068 0.80 ALOX15 (0.36) ALOX15
SCHEMBL10788939 0.79 NPSR1 (0.38)
SCHEMBL3824566 0.79 MMP1 (0.32)
Hydrochloric Acid SCHEMBL16774908 0.74
Hydrochloric Acid SCHEMBL2234352 0.73 CYP3A4 (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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1721522-A2 Substituted phenylketo-enoles as biocides and herbicides Bayer CropScience AG (DE) 2006-11-15 EP disclosed
EP-0891330-B1 SUBSTITUTED PHENYL KETO ENOLS AS PESTICIDES AND HERBICIDES BAYER CROPSCIENCE AG (DE) 2006-03-08 EP disclosed
EP-0837847-B1 2,4,5-TRISUBSTITUTED PHENYLKETO-ENOLS FOR USE AS PESTICIDES AND HERBICIDES BAYER AG (DE) 2002-09-18 EP disclosed
EP-0891330-A1 SUBSTITUTED PHENYL KETO ENOLS AS PESTICIDES AND HERBICIDES BAYER AG (DE) 1999-01-20 EP disclosed
EP-0837847-A1 2,4,5-TRISUBSTITUTED PHENYLKETO-ENOLS FOR USE AS PESTICIDES AND HERBICIDES BAYER AG (DE) 1998-04-29 EP disclosed
WO-1997036868-A1 SUBSTITUTED PHENYL KETO ENOLS AS PESTICIDES AND HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-10-09 WO disclosed
WO-1997001535-A1 2,4,5-TRISUBSTITUTED PHENYLKETO-ENOLS FOR USE AS PESTICIDES AND HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-01-16 WO disclosed