SCHEMBL6443249

SCHEMBL6443249

CCC1OC(C)CN1CCO

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EBP Q15125 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
PDK1 Q15118 1/20 0.33
AGL P35573 1/20 0.32
GAA P10253 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
MGAM O43451 1/20 0.32
GBA1 P04062 1/20 0.32
LCT P09848 1/20 0.32
SI P14410 1/20 0.32

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
SCHEMBL6441865 0.89 EBP (0.37) EBPSIGMAR1PDK1AGLGAA
SCHEMBL6445630 0.85 EBP (0.37) EBPSIGMAR1PDK1AGLGAA
SCHEMBL8559539 0.80 EBP (0.30) EBPSIGMAR1
SCHEMBL6440725 0.78 PDK1 (0.36) EBPSIGMAR1PDK1AGLGAA
SCHEMBL20432916 0.78 PDK1 (0.36) EBPSIGMAR1PDK1AGLGAA
SCHEMBL6442081 0.75 EBP (0.39) EBPSIGMAR1AGLGAAMGAM
SCHEMBL6445093 0.74 PDK1 (0.32) EBPSIGMAR1PDK1
SCHEMBL6441562 0.72 PDK1 (0.32) EBPSIGMAR1PDK1AGLGAA
SCHEMBL296049 0.69 SIGMAR1 (0.55) EBPSIGMAR1PDK1TDP1
SCHEMBL1564250 0.69 SIGMAR1 (0.55) EBPSIGMAR1PDK1TDP1

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-1537158-B1 RADIATION CURED POLYURETHANES WITH CAPPED AMINO GROUPS BASF SE (DE) 2013-04-24 EP disclosed
US-20050244652-A1 Radiation curable polyurethanes with capped amino groups BASF AKTIENGESELLSCHAFT (DE) 2005-11-03 US disclosed