SCHEMBL310867

SCHEMBL310867

CCCOC(=O)CCC(C)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
DGKA P23743 1/20 0.45
ADRA2A P08913 1/20 0.43
ADRA1A P35348 1/20 0.43
ALDH1A1 P00352 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
BLM P54132 1/20 0.42
HSD17B10 Q99714 1/20 0.40
DNM1 Q05193 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KDM4E B2RXH2 1/20 0.37
DUSP3 P51452 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.37
HTR2C P28335 1/20 0.37
NAAA Q02083 1/20 0.36

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
SCHEMBL28205623 0.88 MAPT (0.53) MAPTDGKAADRA2AADRA1AALDH1A1
SCHEMBL11329144 0.88 MAPT (0.53) MAPTDGKAALDH1A1DNM1CYP3A4
SCHEMBL127983 0.85 DGKA (0.47) MAPTDGKAADRA2AADRA1AALDH1A1
SCHEMBL10511231 0.83 MAPT (0.47) MAPTDGKAADRA2AADRA1AALDH1A1
SCHEMBL30173728 0.83 ADRA2A (0.43) MAPTDGKAADRA2AADRA1AALDH1A1
SCHEMBL23159167 0.83 MAPT (0.47) MAPTDGKAADRA2AADRA1AALDH1A1
SCHEMBL20581506 0.83 MAPT (0.47) MAPTDGKAADRA2AADRA1AALDH1A1
SCHEMBL821822 0.83 ADRA2A (0.43) MAPTDGKAADRA2AADRA1AALDH1A1
SCHEMBL985537 0.83 L3MBTL1 (0.52) MAPTALDH1A1L3MBTL1HSD17B10TSHR
SCHEMBL29175194 0.83 L3MBTL1 (0.52) MAPTALDH1A1L3MBTL1HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117143439-A Bio-based flame retardant and application thereof in polylactic acid and/or polyhydroxyalkanoate 中国科学院宁波材料技术与工程研究所 2023-12-01 CN claimed
CN-117143439-A Bio-based flame retardant and application thereof in polylactic acid and/or polyhydroxyalkanoate 中国科学院宁波材料技术与工程研究所 2023-12-01 CN disclosed
EP-2267133-B1 METHOD FOR MAKING POLY(3-HYDROXYPROPRIONATE) CJ RES CENTER LLC (US) 2017-07-12 EP disclosed
US-8093022-B2 polylactones produced in biological system selected from bacteria, yeasts, fungi and plants, expressing enzymes selected from polyhydroxyalkanoate synthase, acyl-CoA transferase and hydroxyacyl CoA transferase, and hydroxyacyl CoA synthetase METABOLIX, INC. (US) 2012-01-10 US disclosed
EP-2267133-A2 Method for making poly(3-hydroxyproprionate) METABOLIX, INC. (US) 2010-12-29 EP disclosed
EP-1078068-B1 POLYHYDROXYALKANOATE BIOPOLYMER COMPOSITIONS METABOLIX INC (US) 2010-09-29 EP disclosed
US-20080275208-A1 POLYHYDROXYALKANOATE BIOPOLYMER COMPOSITIONS METABOLIX, INC. DELAWARE 2008-11-06 US disclosed
US-7202064-B2 Polyhydroxyalkanoate biopolymer compositions METABOLIX, INC. (US) 2007-04-10 US disclosed
US-20040033572-A1 Polyhydroxyalkanoate biopolymer compositions METABOLIX, INC. 2004-02-19 US disclosed
US-6323010-B1 PROVIDING SUBSTRATES WHICH COMPRISE 2-HYDROXYBUTYRIC ACID IN BIOLOGICAL SYSTEM WHICH IS GENETICALLY ENGINEERED TO EXPRESS ONE OR MORE ENZYMES SELECTED FROM THE GROUP CONSISTING OF POLYHYDROXYALKANOATE SYNTHASE, ACYL-COA TRANSFERASE, ETC. METABOLIX, INC. 2001-11-27 US disclosed
EP-1078068-A2 POLYHYDROXYALKANOATE BIOPOLYMER COMPOSITIONS METABOLIX, INC. (US) 2001-02-28 EP disclosed
WO-1999061624-A2 POLYHYDROXYALKANOATE BIOPOLYMER COMPOSITIONS METABOLIX, INC. (US) 1999-12-02 WO disclosed