SCHEMBL7873499

SCHEMBL7873499

CC(=O)Cc1ccc(C#CC(C)(C)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
FFAR1 O14842 2/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 1/20 0.43
PTGES2 Q9H7Z7 1/20 0.42
TSHR P16473 1/20 0.42
POLB P06746 1/20 0.41
GAA P10253 3/20 0.40
ALDH1A1 P00352 1/20 0.40
HAO1 Q9UJM8 1/20 0.40
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ACACB O00763 2/20 0.38
ASIC3 Q9UHC3 1/20 0.38

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
SCHEMBL12391039 0.79 ASIC3 (0.50) MAPTHTTL3MBTL1LMNAPTGES2
SCHEMBL13849645 0.78 CYP2A6 (0.47) MAPTHTTL3MBTL1LMNAPTGES2
SCHEMBL25727921 0.77 LOXL2 (0.45) MAPTHTTL3MBTL1LMNAPTGES2
SCHEMBL737968 0.77 L3MBTL1 (0.52) MAPTHTTL3MBTL1LMNATSHR
SCHEMBL8978722 0.75 PTGES2 (0.47) MAPTHTTL3MBTL1LMNAPTGES2
SCHEMBL8403545 0.74 POLB (0.61) HTTLMNATSHRPOLBGAA
SCHEMBL25727924 0.74 LOXL2 (0.53) MAPTHTTL3MBTL1LMNAPTGES2
SCHEMBL11450794 0.74 POLB (0.48) FFAR1HTTLMNATSHRPOLB
SCHEMBL22442356 0.73 RARB (0.62) MAPTHTTL3MBTL1LMNATSHR
SCHEMBL8978928 0.72 PTGES2 (0.45) MAPTFFAR1LMNAPTGES2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0848701-A1 O-BENZYL OXIME ETHER DERIVATIVES AND THEIR USE IN CROP PROTECTION COMPOSITIONS Novartis AG (CH) 1998-06-24 EP claimed
WO-1997001530-A1 O-BENZYL OXIME ETHER DERIVATIVES AND THEIR USE IN CROP PROTECTION COMPOSITIONS NOVARTIS AG (CH) 1997-01-16 WO claimed
CN-1206914-C Pesticide containing 0-benzyl oximeether derivative and its use NOVARTIS AG (CH) 2005-06-22 CN disclosed
US-6319925-B1 MICROBICIDAL, ACARICIDAL AND INSECTICIDAL PROPERTIES BAYER AKTIENGESELLSCHAFT (DE) 2001-11-20 US disclosed
CN-1309898-A Pesticide containing 0-benzyl oximeether derivative and its use NOVARTIS AG (CH) 2001-08-29 CN disclosed
EP-0848701-B1 O-BENZYL OXIME ETHER DERIVATIVES AND THEIR USE IN CROP PROTECTION COMPOSITIONS NOVARTIS AG (CH) 2000-05-17 EP disclosed
CN-1189150-A O-benzyl oxime ether derivatives and their use in crop protection compositions NOVATIS LTD (CH) 1998-07-29 CN disclosed
EP-0848701-A1 O-BENZYL OXIME ETHER DERIVATIVES AND THEIR USE IN CROP PROTECTION COMPOSITIONS Novartis AG (CH) 1998-06-24 EP disclosed
WO-1997001530-A1 O-BENZYL OXIME ETHER DERIVATIVES AND THEIR USE IN CROP PROTECTION COMPOSITIONS NOVARTIS AG (CH) 1997-01-16 WO disclosed