SCHEMBL24312110

SCHEMBL24312110

CCCC(=O)N(C)CCCCC(N)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 5/20 0.55
NOS2 P35228 4/20 0.55
NOS3 P29474 3/20 0.55
DDAH1 O94760 3/20 0.49
GSR P00390 1/20 0.46
GRIK1 P39086 2/20 0.42
GRIK2 Q13002 2/20 0.42
SLC1A2 P43004 1/20 0.42
SLC1A1 P43005 1/20 0.42
NOD1 Q9Y239 2/20 0.42
EPHX2 P34913 2/20 0.42
ARG2 P78540 4/20 0.42
ARG1 P05089 3/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL4541602 0.87 NOS1 (0.51) NOS1NOS2NOS3DDAH1GSR
SCHEMBL18883517 0.87 NOS1 (0.58) NOS1NOS2NOS3DDAH1GSR
SCHEMBL17841237 0.81 NOS2 (0.64) NOS1NOS2NOS3GSRARG2
SCHEMBL16921496 0.80 NOS1 (0.46) NOS1NOS2NOS3DDAH1GSR
SCHEMBL12492046 0.80 NOS2 (0.67) NOS1NOS2NOS3DDAH1GSR
SCHEMBL27932086 0.80 NOS2 (0.62) NOS1NOS2NOS3GSRARG2
SCHEMBL1768758 0.79 NOS2 (0.53) NOS1NOS2NOS3DDAH1GSR
SCHEMBL1768756 0.79 NOS2 (0.53) NOS1NOS2NOS3DDAH1GSR
SCHEMBL27628164 0.78 NOS1 (0.51) NOS1NOS2NOS3DDAH1GSR
SCHEMBL31370175 0.78 BCHE (0.50) NOS1NOS2NOS3GRIK1

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-2022076905-A1 ALK5 INHIBITORS, CONJUGATES, AND USES THEREOF SILVERBACK THERAPEUTICS, INC. (US) 2022-04-14 WO disclosed