SCHEMBL3628595

SCHEMBL3628595

CCCC(C)(C)C1=CC(=O)C=CC1=O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.39
BACE1 P56817 1/20 0.39
ERBB2 P04626 1/20 0.33
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
ALOX12 P18054 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL11015910 0.89 ACHE (0.44) ACHEBACE1ERBB2MEN1ALDH1A1
SCHEMBL8613270 0.83 ACHE (0.37) ACHEBACE1ERBB2MEN1ALDH1A1
SCHEMBL8926934 0.83 CNR1 (0.33) ALDH1A1MAPTHPGDKMT2A
SCHEMBL10825812 0.80 ACHE (0.38) ACHEBACE1ERBB2
SCHEMBL11153917 0.78 ERBB2 (0.34) ACHEBACE1ERBB2MEN1ALDH1A1
SCHEMBL10825814 0.77 GRM4 (0.40)
SCHEMBL49453 0.73 MAPT (0.43) ACHEBACE1ERBB2MEN1ALDH1A1
SCHEMBL10825822 0.72 TSHR (0.40) ERBB2MEN1ALDH1A1MAPTKMT2A
SCHEMBL28257022 0.72 MAPT (0.41) ACHEBACE1ERBB2MEN1ALDH1A1
Water SCHEMBL28271857 0.72 MAPT (0.41) ACHEBACE1ERBB2MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2142590-A1 PROCESSES FOR PREPARING RUBBER BLEND COMPOSITIONS FLEXSYS AMERICA L.P. (US) 2010-01-13 EP disclosed
WO-2008137570-A1 PROCESSES FOR PREPARING RUBBER BLEND COMPOSITIONS FLEXSYS AMERICA L.P. (US) 2008-11-13 WO disclosed
CN-1228394-C Surface treated carbon black having improved dispersability in rubber and compositions of rubber therefrom having improved processability, rheological and dynamic mechanical properties FLEXSYS AMERICA LP (US) 2005-11-23 CN disclosed
CN-1543488-A Surface-treated carbon blacks with improved dispersion in rubber 2004-11-03 CN disclosed
CN-1153802-C Quinone diimine as a rubber additive ���﹫˾ 2004-06-16 CN disclosed
EP-1025155-A4 QUINONE DIIMINE AS A RUBBER ADDITIVE FLEXSYS AMERICA LP (US) 2001-01-03 EP disclosed
EP-1025155-A1 QUINONE DIIMINE AS A RUBBER ADDITIVE FLEXSYS AMERICA L.P. (US) 2000-08-09 EP disclosed
WO-1999020687-A1 QUINONE DIIMINE AS A RUBBER ADDITIVE FLEXSYS AMERICA L.P. (US) 1999-04-29 WO disclosed