SCHEMBL10884697

SCHEMBL10884697

CC(C)(C)OC(=O)N[C@@](C)(C(N)=O)c1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
POLB P06746 1/20 0.41
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
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
DRD2 P14416 5/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TRPA1 O75762 1/20 0.38
PPARG P37231 1/20 0.37

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
SCHEMBL27159043 0.86 GAA (0.44) GAAPOLBNFKB1NFKB2RELA
SCHEMBL3946429 0.86 GAA (0.44) GAAPOLBNFKB1NFKB2RELA
SCHEMBL10886335 0.86 SCN5A (0.42) GAASMN1; SMN2MAPT
SCHEMBL10885417 0.85 KCNN4 (0.46) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL10886207 0.84 NAMPT (0.46) GAAALDH1A1
SCHEMBL10884877 0.80 ALDH1A1 (0.44) GAAPOLBMEN1KMT2ANPC1
SCHEMBL2490507 0.80 ABCB11 (0.49) GAAPOLBGRIN2DGRIN3BGRIN1
SCHEMBL14847820 0.78 GAA (0.45) GAAPOLBNFKB1NFKB2RELA
SCHEMBL14802198 0.78 GAA (0.45) GAAPOLBNFKB1NFKB2RELA
SCHEMBL10140905 0.78 LMNA (0.40) GAAPOLBDRD2MEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0071926-B1 NEW RIBOFURANURONIC ACID DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-10-08 EP claimed
EP-0071926-B1 NEW RIBOFURANURONIC ACID DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-10-08 EP disclosed
US-4479942-A Tetrahydrofurnancarboxylic acid derivatives, processes for preparation thereof and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-10-30 US disclosed
EP-0071926-A1 New ribofuranuronic acid derivatives, processes for preparation thereof and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-02-16 EP disclosed