SCHEMBL29954495

SCHEMBL29954495

NC(=O)CC1CCN(c2ccccc2C=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
GFER P55789 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LTA4H P09960 1/20 0.41
PTPN1 P18031 1/20 0.40
NPC1 O15118 1/20 0.39
ADRA1D P25100 4/20 0.38
ADRA1A P35348 4/20 0.38
ADRA1B P35368 4/20 0.38
MC4R P32245 1/20 0.38
HSD11B1 P28845 1/20 0.37
GAA P10253 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
USP2 O75604 1/20 0.36
NOTUM Q6P988 1/20 0.36
VNN1 O95497 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
PLA2G1B P04054 1/20 0.36

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
SCHEMBL2552593 1.00 MAPT (0.41) MAPTHTTGFERSMN1; SMN2LTA4H
SCHEMBL1663082 0.83 PTPN1 (0.51) MAPTHTTGFERSMN1; SMN2LTA4H
SCHEMBL3436338 0.82 TSHR (0.50) HTT
SCHEMBL2554368 0.82 GAA (0.53) MAPTGFERSMN1; SMN2NPC1GAA
SCHEMBL2557591 0.82 FFAR4 (0.41) HTTGAAFFAR4
SCHEMBL1663701 0.81 CSF1R (0.45) MAPTHTTGFERSMN1; SMN2LTA4H
SCHEMBL31042529 0.80 CHRM4 (0.50) MAPTGAAFFAR4
SCHEMBL2558642 0.80 GAA (0.46) ADRA1DADRA1AADRA1BHSD11B1GAA
SCHEMBL7484378 0.79 CHRM4 (0.37) MAPTHTTGFERSMN1; SMN2PTPN1
SCHEMBL4703338 0.78 NOTUM (0.50) MAPTLTA4HADRA1DADRA1AADRA1B

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed