SCHEMBL23607690

SCHEMBL23607690

C=C(CCCN)NCCCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 2/20 0.39
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
EPHX1 P07099 3/20 0.38
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38
DNM1 Q05193 6/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
DPP7 Q9UHL4 1/20 0.37
PAOX Q6QHF9 2/20 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
SCHEMBL27005541 0.88 SLC6A5 (0.47) SLC6A5EPHX1GNAI3GNAO1GNAI1
SCHEMBL19988365 0.87 EPHX1 (0.43) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL24238536 0.87 EPHX1 (0.43) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL20863007 0.86 SLC6A5 (0.54) SLC6A5EPHX1GNAI3GNAO1GNAI1
SCHEMBL22099464 0.86 SLC6A5 (0.54) SLC6A5EPHX1GNAI3GNAO1GNAI1
SCHEMBL26019380 0.86 SLC6A5 (0.54) SLC6A5EPHX1GNAI3GNAO1GNAI1
SCHEMBL21076334 0.83 EPHX1 (0.50) EPHX1DNM1
SCHEMBL22447142 0.83 EPHX1 (0.50) EPHX1DNM1
SCHEMBL19176981 0.83 EPHX1 (0.50) EPHX1DNM1
SCHEMBL19336122 0.83 EPHX1 (0.50) EPHX1DNM1

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-2021133839-A1 METHODS OF PREPARING N6-((2-AZIDOETHOXY)CARBONYL)LYSINE Synthorx, Inc. (US) 2021-07-01 WO disclosed