SCHEMBL12373828

SCHEMBL12373828

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.52
GABRD O14764 2/20 0.52
GABRA1 P14867 2/20 0.52
GABRB1 P18505 2/20 0.52
GABRG2 P18507 2/20 0.52
GABRB3 P28472 2/20 0.52
GABRA5 P31644 2/20 0.52
GABRA3 P34903 2/20 0.52
GABRA2 P47869 2/20 0.52
GABRB2 P47870 2/20 0.52
GABRA4 P48169 2/20 0.52
GABRE P78334 2/20 0.52
GABRA6 Q16445 2/20 0.52
GABRG1 Q8N1C3 2/20 0.52
GABRG3 Q99928 2/20 0.52
GABRQ Q9UN88 2/20 0.52
CYP1A2 P05177 2/20 0.52
FOLH1 Q04609 4/20 0.50
TET2 Q6N021 3/20 0.42
KDM4A O75164 2/20 0.42

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
SCHEMBL14360718 0.89 GABRP (0.62) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL14359780 0.86 LMNA (0.43) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL14360105 0.84 ALDH1A1 (0.50) ENPEPLMNA
SCHEMBL304303 0.84 SLC22A6 (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL5077944 0.84 SLC22A6 (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7942715 0.82 ALDH1A1 (0.53) LMNA
SCHEMBL14360237 0.82 ALDH1A1 (0.53) LMNA
SCHEMBL15871660 0.82 GABRP (0.54) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL15062487 0.80 GABRP (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL14360827 0.80 GABRP (0.52) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9340691-B2 Hot melt ink composition comprising a copolyester and process for preparing a copolyester OCE-TECHNOLOGIES B.V. (NL) 2016-05-17 US disclosed
EP-2596960-B1 Reusable print medium and method of manufacturing thereof OCE TECH BV (NL) 2016-04-20 EP disclosed
US-8809432-B2 Reusable print medium and method of manufacturing thereof OCE TECHNOLOGIES B.V. (NL) 2014-08-19 US disclosed
US-20140178635-A1 PANEL AND PANEL INSTALLATION STRUCTURE MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2014-06-26 US disclosed
EP-2726564-A2 HOT MELT INK COMPOSITION COMPRISING A COPOLYESTER AND PROCESS FOR PREPARING A COPOLYESTER OCE-Technologies B.V. (NL) 2014-05-07 EP disclosed
US-20140114013-A1 HOT MELT INK COMPOSITION COMPRISING A COPOLYESTER AND PROCESS FOR PREPARING A COPOLYESTER OCE-TECHNOLOGIES B.V. (NL) 2014-04-24 US disclosed
US-20130137805-A1 REUSABLE PRINT MEDIUM AND METHOD OF MANUFACTURING THEREOF OCE TECHNOLOGIES B.V. (NL) 2013-05-30 US disclosed
EP-2596960-A2 Reusable print medium and method of manufacturing thereof Océ-Technologies B.V. (NL) 2013-05-29 EP disclosed
WO-2013000761-A2 HOT MELT INK COMPOSITION COMPRISING A COPOLYESTER AND PROCESS FOR PREPARING A COPOLYESTER OCE-TECHNOLOGIES B.V. (NL) 2013-01-03 WO disclosed
US-20110200811-A1 FLAME-RETARDANT POLYBUTYLENE TEREPHTHALATE SERIES RESIN COMPOSITION MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2011-08-18 US disclosed