SCHEMBL6439563

SCHEMBL6439563

CC(C=CC(C)CC(=O)O)CC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.43
TDP1 Q9NUW8 1/20 0.41
GABRP O00591 2/20 0.40
GABRD O14764 2/20 0.40
GABRA1 P14867 2/20 0.40
GABRB1 P18505 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA5 P31644 2/20 0.40
GABRA3 P34903 2/20 0.40
GABRA2 P47869 2/20 0.40
GABRB2 P47870 2/20 0.40
GABRA4 P48169 2/20 0.40
GABRE P78334 2/20 0.40
GABRA6 Q16445 2/20 0.40
GABRG1 Q8N1C3 2/20 0.40
GABRG3 Q99928 2/20 0.40
GABRQ Q9UN88 2/20 0.40
HDAC2 Q92769 2/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL6439560 1.00 SLC22A6 (0.43) SLC22A6TDP1GABRPGABRDGABRA1
SCHEMBL22500993 0.90 HDAC2 (0.36) SLC22A6TDP1GABRPGABRDGABRA1
SCHEMBL22500992 0.90 HDAC2 (0.36) SLC22A6TDP1GABRPGABRDGABRA1
SCHEMBL6725633 0.87
SCHEMBL9654395 0.87
SCHEMBL5536864 0.87
SCHEMBL14865320 0.87
SCHEMBL26699371 0.85 GABRP (0.50) SLC22A6TDP1GABRPGABRDGABRA1
SCHEMBL2336525 0.83 ALDH1A1 (0.38) SLC22A6TDP1HDAC2CACNA2D1CACNB3
SCHEMBL9654189 0.83 ALDH1A1 (0.38) SLC22A6TDP1HDAC2CACNA2D1CACNB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1307510-A4 RESIN COMPOSITIONS HAVING BIODEGRADATION AND HYDROLYSIS PROPERTIES JUNG HYO SIG (KR) 2005-03-16 EP claimed
US-6852807-B2 Resin compositions having biodegradation and hydrolysis properties HYO SIG JUNG (KR) 2005-02-08 US claimed
US-20040039135-A1 Resin compositions having biodegradation and hydrolysis properties DAY & DAY CO., LTD. (KP) 2004-02-26 US claimed
EP-1307510-A1 RESIN COMPOSITIONS HAVING BIODEGRADATION AND HYDROLYSIS PROPERTIES Jung, Hyo Sig (KR) 2003-05-07 EP claimed
WO-2002014431-A1 RESIN COMPOSITIONS HAVING BIODEGRADATION AND HYDROLYSIS PROPERTIES JUNG, HYO, SIG (KR) 2002-02-21 WO claimed
EP-1307510-A4 RESIN COMPOSITIONS HAVING BIODEGRADATION AND HYDROLYSIS PROPERTIES JUNG HYO SIG (KR) 2005-03-16 EP disclosed
US-6852807-B2 Resin compositions having biodegradation and hydrolysis properties HYO SIG JUNG (KR) 2005-02-08 US disclosed
US-20040039135-A1 Resin compositions having biodegradation and hydrolysis properties DAY & DAY CO., LTD. (KP) 2004-02-26 US disclosed
CN-1444630-A Resin compositions having biodegradation and hydrolysis properties JUNG HYO SIG (KR) 2003-09-24 CN disclosed
EP-1307510-A1 RESIN COMPOSITIONS HAVING BIODEGRADATION AND HYDROLYSIS PROPERTIES Jung, Hyo Sig (KR) 2003-05-07 EP disclosed
WO-2002014431-A1 RESIN COMPOSITIONS HAVING BIODEGRADATION AND HYDROLYSIS PROPERTIES JUNG, HYO, SIG (KR) 2002-02-21 WO disclosed