SCHEMBL13655375

SCHEMBL13655375

O=C(NCCCN1CCOCC1)C(=O)NCCCN1CCOCC1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.84
KDM4E B2RXH2 1/20 0.84
GAA P10253 2/20 0.81
RAB9A P51151 1/20 0.77
POLB P06746 2/20 0.68
HPGD P15428 1/20 0.68
DUSP3 P51452 1/20 0.68
PKM P14618 1/20 0.67
TP53 P04637 1/20 0.65
ALDH1A1 P00352 1/20 0.64
MAPK1 P28482 1/20 0.64
HIF1A Q16665 1/20 0.64
KMT2A Q03164 3/20 0.63
SMN1; SMN2 Q16637 2/20 0.62
TDP1 Q9NUW8 1/20 0.61
TSHR P16473 1/20 0.59
MAPT P10636 1/20 0.59
HTT P42858 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
EPHX1 P07099 1/20 0.59

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
SCHEMBL29497614 0.90 GAA (1.00) LMNAKDM4EGAARAB9APOLB
SCHEMBL17817601 0.89 LMNA (0.68) LMNAKDM4EGAARAB9APOLB
SCHEMBL8587098 0.89 LMNA (0.68) LMNAKDM4EGAARAB9APOLB
SCHEMBL2347336 0.89 GAA (0.70) LMNAKDM4EGAARAB9APOLB
SCHEMBL30522606 0.88 TDP1 (0.75) LMNAKDM4EGAARAB9APOLB
SCHEMBL76649 0.87 GAA (0.68) LMNAKDM4EGAARAB9APOLB
SCHEMBL611220 0.87 GAA (0.68) LMNAKDM4EGAARAB9APOLB
SCHEMBL8762651 0.85 GAA (0.66) LMNAKDM4EGAARAB9APOLB
SCHEMBL11742767 0.85 LMNA (0.69) LMNAKDM4EGAARAB9APOLB
SCHEMBL2691461 0.85 GAA (0.66) LMNAKDM4EGAARAB9APOLB

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
EP-1468032-B1 ALKYLAMINO OXAMIDES AS LOW ODOR NON FUGITIVE CATALYSTS FOR THE PRODUCTION OF POLYURETHANES MOMENTIVE PERFORMANCE MAT INC (US) 2009-10-21 EP disclosed