SCHEMBL8516788

SCHEMBL8516788

C=C(C)c1cccc(C(C)(CC(C)(C)C)O[O])c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TSHR P16473 2/20 0.42
HTT P42858 2/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GAA P10253 1/20 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
SCHEMBL7138053 0.88 ALDH1A1 (0.43) ALDH1A1L3MBTL1MAPTKDM4ETSHR
SCHEMBL18408453 0.73 ACHE (0.55) ALDH1A1L3MBTL1MAPTKDM4ETSHR
SCHEMBL1707006 0.73 L3MBTL1 (0.47) ALDH1A1L3MBTL1MAPTKDM4ETSHR
SCHEMBL17825579 0.72 ALDH1A1 (0.40) ALDH1A1L3MBTL1MAPTKDM4ETSHR
SCHEMBL4880904 0.72 L3MBTL1 (0.49) ALDH1A1L3MBTL1MAPTKDM4ETSHR
SCHEMBL28237290 0.71 SMN1; SMN2 (0.41) ALDH1A1L3MBTL1MAPTKDM4ETSHR
SCHEMBL9874577 0.71 ALDH1A1 (0.52) ALDH1A1L3MBTL1MAPTKDM4ETSHR
SCHEMBL8680645 0.71 L3MBTL1 (0.48) ALDH1A1L3MBTL1MAPTKDM4ETSHR
SCHEMBL3253267 0.71 L3MBTL1 (0.48) ALDH1A1L3MBTL1MAPTKDM4ETSHR
SCHEMBL20219995 0.71 L3MBTL1 (0.48) ALDH1A1L3MBTL1MAPTKDM4ETSHR

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
EP-0792298-B1 PROCESS FOR PRODUCING MODIFIED RUBBER MOULDING MASSES BY INCORPORATING GROUPS INTO THE RUBBER THAT FORM RADICALS BY THERMAL DECOMPOSITION BASF AG (DE) 1998-09-09 EP claimed
EP-0792300-B1 PROCESS FOR PRODUCING MODIFIED RUBBER MOULDING MASSES BY USING PEROXY GROUP-CONTAINING COMPOUNDS BASF AG (DE) 1999-02-03 EP disclosed
EP-0792298-B1 PROCESS FOR PRODUCING MODIFIED RUBBER MOULDING MASSES BY INCORPORATING GROUPS INTO THE RUBBER THAT FORM RADICALS BY THERMAL DECOMPOSITION BASF AG (DE) 1998-09-09 EP disclosed
EP-0792300-A2 PROCESS FOR PRODUCING MODIFIED RUBBER MOULDING MASSES BY USING PEROXY GROUP-CONTAINING COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 1997-09-03 EP disclosed
WO-1996015164-A1 PROCESS FOR PRODUCING MODIFIED RUBBER MOULDING MASSES BY USING PEROXY GROUP-CONTAINING COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 1996-05-23 WO disclosed