SCHEMBL8307153

SCHEMBL8307153

OCCON=Cc1ccc2ccccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
KDM4E B2RXH2 3/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
GRIN2D O15399 2/20 0.47
GRIN3B O60391 2/20 0.47
GRIN1 Q05586 2/20 0.47
GRIN2A Q12879 2/20 0.47
GRIN2B Q13224 2/20 0.47
GRIN2C Q14957 2/20 0.47
GRIN3A Q8TCU5 2/20 0.47
DHODH Q02127 1/20 0.46
LMNA P02545 4/20 0.44
HTT P42858 1/20 0.44
PTGS1 P23219 1/20 0.44
NPSR1 Q6W5P4 1/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 3/20 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
SCHEMBL8307151 1.00 ALDH1A1 (0.54) ALDH1A1KDM4EL3MBTL1GRIN2DGRIN3B
SCHEMBL14353303 0.80 ALDH1A1 (0.53) ALDH1A1KDM4EL3MBTL1GRIN2DGRIN3B
SCHEMBL13351487 0.80 ALDH1A1 (0.53) ALDH1A1KDM4EL3MBTL1GRIN2DGRIN3B
SCHEMBL8306342 0.79 TAAR1 (0.47) ALDH1A1L3MBTL1GRIN2DGRIN3BGRIN1
SCHEMBL8306343 0.79 TAAR1 (0.47) ALDH1A1L3MBTL1GRIN2DGRIN3BGRIN1
SCHEMBL8307351 0.79 RAB9A (0.50) ALDH1A1KDM4EL3MBTL1LMNANPSR1
SCHEMBL8307350 0.79 RAB9A (0.50) ALDH1A1KDM4EL3MBTL1LMNANPSR1
SCHEMBL6208715 0.77 PPARG (0.51) ALDH1A1KDM4EL3MBTL1GRIN2DGRIN3B
SCHEMBL6208719 0.77 PPARG (0.51) ALDH1A1KDM4EL3MBTL1GRIN2DGRIN3B
SCHEMBL8308910 0.77 HDAC2 (0.54) ALDH1A1L3MBTL1LMNAMEN1KMT2A

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