SCHEMBL14906335

SCHEMBL14906335

CCCCCCCCCCC(O)CN(CC(O)CCCCCCCCCC)C(Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 2/20 0.51
MAPT P10636 2/20 0.51
APAF1 O14727 1/20 0.51
POLB P06746 1/20 0.51
RECQL P46063 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MEN1 O00255 1/20 0.51
LMNA P02545 1/20 0.51
MPO P05164 1/20 0.51
TSHR P16473 1/20 0.51
BLM P54132 1/20 0.51
PMP22 Q01453 1/20 0.51
KMT2A Q03164 1/20 0.51
HIF1A Q16665 1/20 0.51
BCHE P06276 1/20 0.48
MMP2 P08253 3/20 0.47
MMP8 P22894 3/20 0.47
MMP9 P14780 2/20 0.47
CCKBR P32239 1/20 0.46

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
SCHEMBL14906259 0.86 BCHE (0.59) SMN1; SMN2KDM4EMAPTAPAF1POLB
SCHEMBL6010174 0.83 SMN1; SMN2 (0.60) SMN1; SMN2KDM4EMAPTAPAF1POLB
SCHEMBL6010161 0.83 SMN1; SMN2 (0.60) SMN1; SMN2KDM4EMAPTAPAF1POLB
SCHEMBL30735894 0.81 KDM4E (0.64) SMN1; SMN2KDM4EMAPTAPAF1POLB
SCHEMBL14906282 0.80 CSNK1E (0.50) MMP2MMP1
Dl-Tryptophan SCHEMBL28198688 0.79 KDM4E (0.67) SMN1; SMN2KDM4EMAPTAPAF1POLB
Tryptophan SCHEMBL28198687 0.79 KDM4E (0.67) SMN1; SMN2KDM4EMAPTAPAF1POLB
SCHEMBL15044779 0.78 GPR84 (0.45) SMN1; SMN2KDM4EMAPTAPAF1POLB
SCHEMBL7766717 0.78 KDM4E (0.55) SMN1; SMN2KDM4EMAPTAPAF1POLB
SCHEMBL7766713 0.78 KDM4E (0.55) SMN1; SMN2KDM4EMAPTAPAF1POLB

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
WO-2013063468-A1 AMINO ACID DERIVATES FUNCTIONALIZED ON THE N- TERMINAL CAPABLE OF FORMING DRUG INCAPSULATING MICROSPHERES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-05-02 WO disclosed