SCHEMBL22435

SCHEMBL22435

O=C(ON1C(=O)CCC1=O)C(CCc1ccccc1)N1C(=O)C=CC1=O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
PKM P14618 1/20 0.44
P2RX7 Q99572 1/20 0.38
MGLL Q99685 3/20 0.37
GSK3A P49840 2/20 0.37
GSK3B P49841 2/20 0.37
SLC1A2 P43004 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
DNMT1 P26358 1/20 0.37
MAPK1 P28482 1/20 0.36
CNR2 P34972 1/20 0.36
TSHR P16473 1/20 0.36
POLB P06746 1/20 0.35
FAAH O00519 1/20 0.35
CYP2C19 P33261 1/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL11030140 0.83 ALDH1A1 (0.42) ALDH1A1PKMSLC1A2SMN1; SMN2DNMT1
SCHEMBL502096 0.80 ALDH1A1 (0.34) ALDH1A1PKMMGLLGSK3AGSK3B
SCHEMBL92947 0.78 CA2 (0.33) ALDH1A1MGLLGSK3AGSK3BSMN1; SMN2
SCHEMBL1824376 0.78 DNMT1 (0.48) ALDH1A1PKMMGLLGSK3AGSK3B
SCHEMBL3735742 0.77 ALDH1A1 (0.36) ALDH1A1PKMMGLLGSK3AGSK3B
SCHEMBL12275897 0.76 SMN1; SMN2 (0.36) ALDH1A1MGLLSMN1; SMN2FAAHCYP2C19
SCHEMBL16628548 0.76 POLB (0.50) ALDH1A1MGLLGSK3AGSK3BDNMT1
SCHEMBL11129630 0.75 SMN1; SMN2 (0.31) ALDH1A1GSK3AGSK3BSMN1; SMN2CYP2C19
SCHEMBL15587063 0.74 FAAH (0.42) ALDH1A1PKMSLC1A2TSHRFAAH
SCHEMBL15550245 0.74 FAAH (0.42) ALDH1A1PKMSLC1A2TSHRFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609119-B1 CHITINOUS POLYSACCHARIDE ANTIGEN BINDING PROTEINS AGROSAVFE N V (BE) 2017-10-18 EP disclosed
EP-2609115-B1 COMPOSITIONS FOR SEED TREATMENT AGROSAVFE N V (BE) 2017-05-31 EP disclosed
US-9516879-B2 Chitinous polysaccharide antigen-binding proteins AGROSAVFE N.V. (BE) 2016-12-13 US disclosed
US-9380781-B2 Compositions for seed treatment AGROSAVFE N.V. (BE) 2016-07-05 US disclosed
US-20130227747-A1 CHITINOUS POLYSACCHARIDE ANTIGEN-BINDING PROTEINS AGROSAVFE N.V. (BE) 2013-08-29 US disclosed
US-20130225403-A1 COMPOSITIONS FOR SEED TREATMENT AGROSAVFE N.V. (BE) 2013-08-29 US disclosed
EP-2609119-A1 CHITINOUS POLYSACCHARIDE ANTIGEN BINDING PROTEINS AGROSAVFE N.V. (BE) 2013-07-03 EP disclosed
EP-2609115-A1 COMPOSITIONS FOR SEED TREATMENT AGROSAVFE N.V. (BE) 2013-07-03 EP disclosed
WO-2012025619-A1 CHITINOUS POLYSACCHARIDE ANTIGEN BINDING PROTEINS VIB VZW (BE) 2012-03-01 WO disclosed
WO-2012025621-A1 COMPOSITIONS FOR SEED TREATMENT VIB VZW (BE) 2012-03-01 WO disclosed