SCHEMBL7873411

SCHEMBL7873411

CCC(=O)c1ccc(C#CC(C)(C)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.53
▸ L3MBTL1 Q9Y468 3/20 0.49
▸ HTT P42858 3/20 0.49
▸ LMNA P02545 1/20 0.49
▸ SMN1; SMN2 Q16637 5/20 0.45
▸ TSHR P16473 1/20 0.45
▸ RAB9A P51151 4/20 0.43
▸ NPC1 O15118 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ RARB P10826 1/20 0.41
▸ RARG P13631 1/20 0.41
▸ HAO1 Q9UJM8 1/20 0.40
▸ MMP2 P08253 2/20 0.38
▸ MMP12 P39900 2/20 0.38
▸ ASIC3 Q9UHC3 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PTGES2 Q9H7Z7 1/20 0.37
▸ PGR P06401 1/20 0.37
▸ GAA P10253 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
SCHEMBL12692259 0.88 MAPT (0.46) MAPTL3MBTL1HTTLMNASMN1; SMN2
SCHEMBL737968 0.80 L3MBTL1 (0.52) MAPTL3MBTL1HTTLMNASMN1; SMN2
SCHEMBL22442356 0.80 RARB (0.62) MAPTL3MBTL1HTTLMNASMN1; SMN2
SCHEMBL10412424 0.80 MAPT (0.52) MAPTL3MBTL1HTTSMN1; SMN2RAB9A
SCHEMBL12391039 0.79 ASIC3 (0.50) MAPTL3MBTL1HTTLMNASMN1; SMN2
SCHEMBL18529382 0.79 MAPT (0.56) MAPTL3MBTL1HTTLMNASMN1; SMN2
SCHEMBL19543261 0.78 MAPT (0.50) MAPTL3MBTL1HTTSMN1; SMN2RAB9A
SCHEMBL12692232 0.77 SMN1; SMN2 (0.63) MAPTL3MBTL1HTTLMNASMN1; SMN2
SCHEMBL22031725 0.76 LMNA (0.59) MAPTL3MBTL1HTTLMNASMN1; SMN2
SCHEMBL739253 0.76 HTT (0.52) MAPTL3MBTL1HTTLMNASMN1; SMN2

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 6 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
US-6319925-B1 MICROBICIDAL, ACARICIDAL AND INSECTICIDAL PROPERTIES BAYER AKTIENGESELLSCHAFT (DE) 2001-11-20 — — US disclosed
EP-0848701-B1 O-BENZYL OXIME ETHER DERIVATIVES AND THEIR USE IN CROP PROTECTION COMPOSITIONS NOVARTIS AG (CH) 2000-05-17 — — EP 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
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