SCHEMBL29323648

SCHEMBL29323648

CNn1[nH]c(=O)n(-c2ccccc2)c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 4/20 0.47
GSK3B P49841 4/20 0.47
GAA P10253 1/20 0.47
PGR P06401 3/20 0.44
NTRK1 P04629 4/20 0.42
NTRK2 Q16620 4/20 0.42
IGF1R P08069 3/20 0.42
FGFR1 P11362 3/20 0.42
NTRK3 Q16288 2/20 0.42
MAPK1 P28482 2/20 0.41
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
RAB9A P51151 1/20 0.38
MAPK8 P45983 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL5326615 0.76 GSK3A (0.55) GSK3AGSK3BGAAPGRNTRK1
SCHEMBL11684638 0.74 NTRK1 (0.53) GSK3AGSK3BGAANTRK1NTRK2
SCHEMBL264757 0.73 GSK3A (0.54) GSK3AGSK3BGAAPGRNTRK1
SCHEMBL3909707 0.72 GSK3A (0.52) GSK3AGSK3BGAAPGRNTRK1
SCHEMBL3907921 0.71 GSK3A (0.47) GSK3AGSK3BGAAPGRNTRK1
SCHEMBL265665 0.71 GAA (0.50) GSK3AGSK3BGAAPGRNTRK1
SCHEMBL13562509 0.71 PGR (0.51) GSK3AGSK3BGAAPGRNTRK1
SCHEMBL23895082 0.70 GSK3A (0.50) GSK3AGSK3BGAAPGRNTRK1
SCHEMBL3906792 0.70 GSK3A (0.46) GSK3AGSK3BGAAPGRNTRK1
SCHEMBL5198556 0.70 NTRK1 (0.72) GSK3AGSK3BGAANTRK1NTRK2

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-2024149845-A1 METHODS FOR CELL SURFACE REMODELING NANTES UNIVERSITÉ (FR) 2024-07-18 WO disclosed