SCHEMBL9717468

SCHEMBL9717468

O=C(O)CCNC(=O)CC(=O)NCCC(=O)O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 4/20 0.81
EGLN1 Q9GZT9 2/20 0.44
LMNA P02545 2/20 0.44
ALKBH5 Q6P6C2 1/20 0.44
SUCNR1 Q9BXA5 1/20 0.44
KDM4E B2RXH2 3/20 0.43
KDM5C P41229 2/20 0.43
PHF8 Q9UPP1 2/20 0.43
KDM2A Q9Y2K7 2/20 0.43
KDM6B O15054 1/20 0.43
FOLH1 Q04609 1/20 0.43
FAAH O00519 2/20 0.43
CNR1 P21554 2/20 0.43
CNR2 P34972 2/20 0.43
PRMT1 Q99873 1/20 0.42
PLA2G2A P14555 1/20 0.42
HTT P42858 1/20 0.42
TSHR P16473 1/20 0.42
ATM Q13315 1/20 0.41
ITGB3 P05106 1/20 0.41

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
SCHEMBL27858651 0.92 ECE1 (0.70) ECE1EGLN1LMNAALKBH5SUCNR1
SCHEMBL9717431 0.88 ECE1 (0.65) ECE1EGLN1LMNAALKBH5SUCNR1
SCHEMBL19068037 0.88 ECE1 (0.65) ECE1EGLN1LMNAKDM4EKDM5C
SCHEMBL8531287 0.86 ECE1 (0.62) ECE1EGLN1LMNAALKBH5SUCNR1
SCHEMBL2561173 0.85 ECE1 (0.61) ECE1EGLN1LMNAKDM4EKDM5C
SCHEMBL4811364 0.83 ECE1 (0.60) ECE1EGLN1LMNAALKBH5SUCNR1
SCHEMBL8194422 0.83 ECE1 (0.60) ECE1EGLN1LMNAALKBH5SUCNR1
SCHEMBL9717382 0.83 ECE1 (0.60) ECE1LMNAFAAHCNR1CNR2
SCHEMBL9717391 0.83 ECE1 (0.60) ECE1LMNAKDM4EFAAHCNR1
SCHEMBL9717419 0.83 ECE1 (0.60) ECE1LMNAKDM4EPRMT1TSHR

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-5086104-A Mixture of thermoplastic resin, elastomer and amide compound, excellent toughtness, heat resistance and durability POLYPLASTICS CO., LTD. (JP) 1992-02-04 US disclosed