SCHEMBL8305075

SCHEMBL8305075

CC(=NOCCO)c1ccc(OC(C)C)nc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MET P08581 6/20 0.36
ALDH1A1 P00352 1/20 0.36
ACACB O00763 8/20 0.36
ACACA Q13085 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 2/20 0.35
PTBP1 P26599 1/20 0.35
PDE10A Q9Y233 1/20 0.34
PDE3B Q13370 4/20 0.34
PDE3A Q14432 4/20 0.34
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL8305073 1.00 MET (0.36) METALDH1A1ACACBACACASMN1; SMN2
SCHEMBL8307070 0.85 NNMT (0.46) METSMN1; SMN2LMNAPTBP1PDE3B
SCHEMBL8307069 0.85 NNMT (0.46) METSMN1; SMN2LMNAPTBP1PDE3B
SCHEMBL8309510 0.83 MAPT (0.51) METACACBSMN1; SMN2LMNAPTBP1
SCHEMBL8309507 0.83 MAPT (0.51) METACACBSMN1; SMN2LMNAPTBP1
SCHEMBL8687164 0.79 ALDH1A1 (0.38) ALDH1A1ACACBACACAPDE10AMAPT
SCHEMBL8304738 0.78 ALDH1A1 (0.42) ALDH1A1ACACBACACAPDE10AMAPT
SCHEMBL29483234 0.78 ALDH1A1 (0.42) ALDH1A1ACACBACACAPDE10AMAPT
SCHEMBL8309324 0.76 MEN1 (0.41) ACACBACACAL3MBTL1
SCHEMBL8304541 0.73 PPARG (0.54) METALDH1A1SMN1; SMN2LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5972959-A Oxime derivatives, their preparation and their therapeutic use SANKYO COMPANY, LIMITED (JP) 1999-10-26 US disclosed
EP-0708098-B1 Oxime derivatives, their preparation and their therapeutic use SANKYO CO (JP) 1999-03-03 EP disclosed
US-5780490-A A O-(2,4-OXA(OR THIA)ZOLIDINYL)PHENYLOXY(OR THIO OR AMINO) ALKYLOXIME; ALDOSE REDUCTASE INHIBITORS; ANTIDIABETIC AND -HYPOGLYCEMIC AGENTS; LIVER, SKIN AND UROGENITAL DISORDERS SANKYO COMPANY, LIMITED (JP) 1998-07-14 US disclosed
US-5703096-A ANTIDIABETIC AGENTS; ALDOSE REDUCTASE INHIBITOR SANKYO COMPANY, LIMITED (JP) 1997-12-30 US disclosed
EP-0708098-A1 Oxime derivatives, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1996-04-24 EP disclosed