SCHEMBL7992282

SCHEMBL7992282

CCc1ncnc(NC2COC(C)(C)OC2)c1Cl

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
IRAK4 Q9NWZ3 5/20 0.32
CHRM4 P08173 4/20 0.31
MEN1 O00255 1/20 0.30

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
SCHEMBL19287695 0.86 KDM4E (0.36) KDM4EIRAK4CHRM4MEN1
SCHEMBL9061374 0.78 KDM4E (0.37) KDM4EIRAK4CHRM4MEN1
SCHEMBL7970268 0.77 KDM4E (0.33) KDM4ECHRM4
SCHEMBL8485612 0.76 KDM4E (0.38) KDM4EIRAK4CHRM4MEN1
SCHEMBL8767585 0.76 KDM4E (0.38) KDM4EIRAK4CHRM4MEN1
SCHEMBL7977980 0.75 TP53 (0.33) KDM4EIRAK4CHRM4
SCHEMBL8486785 0.75 BTK (0.42) KDM4EIRAK4
SCHEMBL8487365 0.75 BTK (0.42) KDM4EIRAK4
SCHEMBL7828462 0.75 CYP1A2 (0.43) KDM4EIRAK4MEN1
SCHEMBL8490025 0.75 IRAK4 (0.45) KDM4EIRAK4CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6281221-B1 Substituted 1,3-dioxan-5-ylamino-hererocyclic compounds, processes for their preparation and their use as pest control compositions HOECHST SCERING AGREVO GMBH (DE) 2001-08-28 US disclosed
EP-0836603-A1 SUBSTITUTED 1,3-DIOXAN-5-YLAMINO HETEROCYCLIC COMPOUNDS, METHODS FOR PREPARING THEM AND THEIR USE AS PESTICIDES Hoechst Schering AgrEvo GmbH (DE) 1998-04-22 EP disclosed
WO-1997002264-A1 SUBSTITUTED 1,3-DIOXAN-5-YLAMINO HETEROCYCLIC COMPOUNDS, METHODS FOR PREPARING THEM AND THEIR USE AS PESTICIDES HOECHST SCHERING AGREVO GMBH (DE) 1997-01-23 WO disclosed