SCHEMBL28977313

SCHEMBL28977313

CC(C)CCNC(C)S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 3/20 0.32
RNPEP Q9H4A4 2/20 0.32
DNPEP Q9ULA0 2/20 0.32
GRIA1 P42261 3/20 0.32
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
GAA P10253 1/20 0.31
HTT P42858 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30
NPC1 O15118 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CA1 P00915 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
SCHEMBL28387464 0.83 GRIA1 (0.36) GRIA1
SCHEMBL26137918 0.82 ANPEP (0.35) ANPEPRNPEPDNPEPGRIA1RAB9A
SCHEMBL28096531 0.79 CA1 (0.39) GRIA1GAACA1
SCHEMBL2869288 0.79 GRIA1 (0.33) GRIA1KMT2A
SCHEMBL23926322 0.79 MEN1 (0.34) GRIA1KMT2A
SCHEMBL11145285 0.77 GRIA1 (0.37) GRIA1
SCHEMBL148567 0.77 GABRR1 (0.33) GRIA1
SCHEMBL19583223 0.77 PTGS1 (0.33) GRIA1
SCHEMBL26137936 0.77 ANPEP (0.33) ANPEPRNPEPDNPEP
SCHEMBL11667830 0.76 TP53 (0.45) SMN1; SMN2CA1

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-115718130-A Renewable polymer film potential type anti-fouling sensor and application thereof 中国科学院烟台海岸带研究所 2023-02-28 CN claimed