SCHEMBL28293278

SCHEMBL28293278

NC1CCCCC1(N)C(=O)C1(N)CCCCC1N

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 3/20 0.32
ARG2 P78540 2/20 0.32
HSD11B1 P28845 1/20 0.31
GRM8 O00222 1/20 0.31
GRM6 O15303 1/20 0.31
GRM2 Q14416 1/20 0.31
GRM3 Q14832 1/20 0.31
NSD2 O96028 1/20 0.30

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
SCHEMBL9180033 0.84 EPHX1 (0.31) ARG1ARG2
SCHEMBL2939527 0.84 GRM2 (0.46) ARG1ARG2GRM8GRM6GRM2
SCHEMBL7135246 0.84 GRM2 (0.46) ARG1ARG2GRM8GRM6GRM2
SCHEMBL9180035 0.84 EPHX1 (0.31) ARG1ARG2
SCHEMBL28434000 0.83 GRM2 (0.44) ARG1ARG2GRM8GRM6GRM2
SCHEMBL28909434 0.81 TSHR (0.30)
SCHEMBL9193073 0.78 ARG1 (0.31) ARG1ARG2
SCHEMBL9193078 0.78 ARG1 (0.31) ARG1ARG2
SCHEMBL7802417 0.78 ARG1 (0.31) ARG1ARG2
SCHEMBL7752047 0.77 GRM2 (0.47) ARG1ARG2GRM8GRM6GRM2

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
CN-109627212-A A kind of diacid monomer and preparation method thereof and polyamide and preparation method thereof 吉林大学 2019-04-16 CN disclosed