SCHEMBL13847007

SCHEMBL13847007

CC(O)Cn1c(=O)n(C)c(=O)n(CO)c1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 1/20 0.35
AGER Q15109 1/20 0.34
MAPK1 P28482 3/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 2/20 0.33
ATM Q13315 1/20 0.32
PDE2A O00408 2/20 0.30
CFTR P13569 2/20 0.30
PDE1A P54750 2/20 0.30
PDE1B Q01064 2/20 0.30
PDE1C Q14123 2/20 0.30
PDE5A O76074 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
PDE4A P27815 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
SCHEMBL11690456 0.92 KDM4E (0.39) RAB9ALMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL260676 0.83 KDM4E (0.43) RAB9ALMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL30872057 0.80 KDM4E (0.37) RAB9ALMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL13637013 0.79 RAB9A (0.36) RAB9ALMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL11694351 0.79 APEX1 (0.39) RAB9ALMNAALDH1A1KDM4EMAPK1
SCHEMBL10711246 0.77 KDM4E (0.40) RAB9ALMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL13413746 0.76 LMNA (0.43) LMNASMN1; SMN2ALDH1A1KDM4EAGER
SCHEMBL25588847 0.75 CYP3A4 (0.48) RAB9ALMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL14283656 0.74 KDM4E (0.38) RAB9ALMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL18503887 0.72 GRIN1 (0.44) LMNASMN1; SMN2ALDH1A1AGERHTT

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-1423465-B1 FLAME RETARDANT COMPOSITIONS CIBA HOLDING INC (CH) 2009-05-27 EP disclosed