SCHEMBL8308938

SCHEMBL8308938

CC(=NO)c1ccc(-c2ccncc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 6/20 0.46
CYP19A1 P11511 6/20 0.46
CYP11B1 P15538 6/20 0.46
CYP11B2 P19099 6/20 0.46
CYP3A4 P08684 5/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
KDM4E B2RXH2 1/20 0.42
KIF11 P52732 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
BRAF P15056 1/20 0.41
MAPK3 P27361 1/20 0.41
MAPK1 P28482 1/20 0.41
QDPR P09417 1/20 0.41
CA9 Q16790 1/20 0.40
NOTUM Q6P988 1/20 0.39

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
SCHEMBL2954565 0.87 L3MBTL1 (0.52) MAPTKDM4ESMN1; SMN2L3MBTL1
SCHEMBL2954564 0.87 L3MBTL1 (0.52) MAPTKDM4ESMN1; SMN2L3MBTL1
SCHEMBL11482231 0.87 L3MBTL1 (0.52) MAPTKDM4ESMN1; SMN2L3MBTL1
SCHEMBL13645704 0.87 CA9 (0.47) CYP3A4MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL8306869 0.80 MKNK1 (0.57) CYP19A1CYP11B1CYP11B2CYP3A4MAPT
SCHEMBL14298196 0.79 CA9 (0.52) CYP3A4MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL12360950 0.79 CA9 (0.52) CYP3A4MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL29103210 0.79 KDM1A (0.51) CYP3A4MAPTLMNAHDAC1HDAC6
SCHEMBL8306282 0.78 CA9 (0.51) CYP3A4MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL3368876 0.78 SMN1; SMN2 (0.56) MAPTLMNAKDM4ESMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1056840-C Oxime derivatives, their preparation and their therapeutic use SANKYO CO (JP) 2000-09-27 CN disclosed
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
CN-1143639-A Oxime derivatives, their preparation and their therapeutic use SANKYO CO (JP) 1997-02-26 CN disclosed
EP-0708098-A1 Oxime derivatives, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1996-04-24 EP disclosed