SCHEMBL5014975

SCHEMBL5014975

O=C(O)CCNCC(O)CNCC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.36
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
TET2 Q6N021 3/20 0.33
KDM4A O75164 2/20 0.33
KDM4C Q9H3R0 2/20 0.33
KDM2A Q9Y2K7 2/20 0.33
ECE1 P42892 2/20 0.33
SLC22A6 Q4U2R8 2/20 0.33
LMNA P02545 2/20 0.33
TET3 O43151 1/20 0.33
ALKBH5 Q6P6C2 1/20 0.33
SUCNR1 Q9BXA5 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
PTPN1 P18031 1/20 0.33
FAAH O00519 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HTT P42858 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
SCHEMBL5014963 0.93 LMNA (0.38) CYP1A2ADRB2ADRB1ADRB3TET2
SCHEMBL5014969 0.89 SLC22A6 (0.41) CYP1A2ADRB2ADRB1ADRB3TET2
SCHEMBL10800661 0.79 LMNA (0.38) TET2KDM4AKDM4CKDM2AECE1
SCHEMBL158810 0.78 LMNA (0.47) KDM2AECE1SLC22A6LMNAALKBH5
SCHEMBL983155 0.77 LMNA (0.36) CYP1A2ADRB2ADRB1ADRB3TET2
SCHEMBL14393150 0.77 SLC22A6 (0.32) SLC22A6LMNAALKBH5SUCNR1EGLN1
Hydrochloric Acid SCHEMBL28658324 0.76 LMNA (0.44) KDM2AECE1SLC22A6LMNAALKBH5
SCHEMBL8186348 0.76 LMNA (0.44) KDM2AECE1SLC22A6LMNAALKBH5
SCHEMBL1829861 0.76 LMNA (0.35) TET2KDM4AKDM4CKDM2AECE1
SCHEMBL7179855 0.76 KDM4E (0.41) CYP1A2ADRB2ECE1LMNAALKBH5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080115423-A1 Polishing Composition For Silicon Wafer NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2008-05-22 US disclosed