SCHEMBL1779515

SCHEMBL1779515

C=C(C)C(=O)OC(C)OC(=O)CCCC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.44
SLC22A6 Q4U2R8 1/20 0.37
LMNA P02545 5/20 0.36
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 2/20 0.32
AKR1B1 P15121 1/20 0.31
MAPK1 P28482 2/20 0.31
MEN1 O00255 1/20 0.31
GMNN O75496 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MAPT P10636 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NR1H4 Q96RI1 1/20 0.31
NFKB1 P19838 1/20 0.31
PMP22 Q01453 1/20 0.31
TP53 P04637 1/20 0.31
CYP2C9 P11712 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL28959487 0.97 TSHR (0.40) TSHRSLC22A6LMNAALDH1A1CYP1A2
SCHEMBL9158781 0.93 TSHR (0.42) TSHRLMNAALDH1A1MAPK1MAPT
SCHEMBL40324 0.90 TSHR (0.40) TSHRLMNAALDH1A1CYP1A2
SCHEMBL9160171 0.90 LMNA (0.44) TSHRLMNAALDH1A1CYP1A2MAPK1
SCHEMBL384674 0.86 TSHR (0.45) TSHRLMNAALDH1A1
SCHEMBL28959486 0.83 TSHR (0.38) TSHRLMNAALDH1A1
SCHEMBL20495002 0.83 CYP1A2 (0.42) TSHRLMNAALDH1A1CYP1A2MAPK1
SCHEMBL11743243 0.82 LMNA (0.59) TSHRLMNAALDH1A1MAPK1MEN1
Succinic Acid SCHEMBL28959480 0.81 TSHR (0.41) TSHRLMNAALDH1A1CYP1A2MAPT
SCHEMBL9160879 0.80 TSHR (0.47) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115710277-A Ethylene glycol unit-containing alkenyl-terminated tetraaryl porphyrin compound and preparation method and application thereof 江苏海伦隐形眼镜有限公司 2023-02-24 CN disclosed
EP-1699790-B1 SOLUBLE POLYMERS AS AMINE CAPTURE AGENTS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2012-09-05 EP disclosed
EP-1700107-B1 ACOUSTIC SENSORS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2011-09-14 EP disclosed
US-7943388-B2 Acoustic sensors and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-05-17 US disclosed
US-7521516-B2 pendant acylsulfonamide amine-reactive groups; for covalent attachment of amine-containing analytes, amino acids, DNA fragments, RNA fragments, protein fragments, organelles, and immunoglobins, immobilized on the surface of a substrate 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-04-21 US disclosed
US-20080132665-A1 SOLUBLE POLYMERS AS AMINE CAPTURE AGENTS AND METHODS BENSON KARL E 2008-06-05 US disclosed
US-7342082-B2 Soluble polymers as amine capture agents and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-03-11 US disclosed
US-20070190662-A1 Acoustic sensors and methods 3M INNOVATIVE PROPERTIES COMPANY 2007-08-16 US disclosed
WO-2005066092-A9 ACOUSTIC SENSORS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2006-09-14 WO disclosed
EP-1699790-A2 SOLUBLE POLYMERS AS AMINE CAPTURE AGENTS AND METHODS 3M Innovative Properties Company (US) 2006-09-13 EP disclosed
EP-1700107-A2 ACOUSTIC SENSORS AND METHODS 3M Innovative Properties Company (US) 2006-09-13 EP disclosed
US-20060135718-A1 Soluble polymers as amine capture agents and methods 3M INNOVATIVE PROPERTIES COMPANY 2006-06-22 US disclosed
WO-2005065370-A2 SOLUBLE POLYMERS AS AMINE CAPTURE AGENTS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-07-21 WO disclosed
WO-2005066092-A2 ACOUSTIC SENSORS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-07-21 WO disclosed