SCHEMBL4772460

SCHEMBL4772460

C=CC(=O)OCC=CCCCC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.58
HPGD P15428 1/20 0.58
ALDH1A1 P00352 3/20 0.44
CYP3A4 P08684 2/20 0.44
F7 P08709 2/20 0.43
F3 P13726 2/20 0.43
FAAH O00519 4/20 0.40
TP53 P04637 3/20 0.39
HSD17B10 Q99714 3/20 0.39
HIF1A Q16665 2/20 0.39
TERT O14746 3/20 0.39
CYP1A2 P05177 2/20 0.39
MAPT P10636 2/20 0.39
CYP2C19 P33261 2/20 0.39
BLM P54132 2/20 0.39
FABP4 P15090 2/20 0.39
PTPN1 P18031 2/20 0.39
PPARG P37231 2/20 0.39
KMT2A Q03164 2/20 0.39
PPARD Q03181 2/20 0.39

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
SCHEMBL27843204 0.93 HPGD (0.55) TSHRHPGDCYP3A4F7F3
SCHEMBL7151789 0.93 HPGD (0.55) TSHRHPGDCYP3A4F7F3
SCHEMBL27843203 0.93 HPGD (0.55) TSHRHPGDCYP3A4F7F3
SCHEMBL28209239 0.89 TSHR (0.52) TSHRHPGDALDH1A1CYP3A4TP53
Acetic Acid SCHEMBL27860763 0.89 HPGD (0.50) TSHRHPGDF7F3FAAH
SCHEMBL4623390 0.85 TSHR (0.75) TSHRHPGDALDH1A1CYP3A4F7
SCHEMBL85756 0.83 TSHR (0.45) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL8961912 0.83 F7 (0.44) CYP3A4F7F3FAAHTP53
SCHEMBL29214424 0.82 TSHR (0.70) TSHRHPGDALDH1A1CYP3A4F7
SCHEMBL29214413 0.82 TSHR (0.70) TSHRHPGDALDH1A1CYP3A4F7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1638539-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING PH-SENSITIVE BLOCK COPOLYMERS AND A HYDROPHOBIC DRUG UNIV MONTREAL (CA) 2008-12-31 EP claimed
US-6822052-B2 SOLVOLYSIS THE ETHYLENE-METHYL ACRYLATE COPOLYMER BY A CYANOACRYLATE MONOMER, ADDITION POLYMERIZATION, PHASE SEPARATION DURING THE PHOTOCURING PROCESS HENKEL CORPORATION 2004-11-23 US disclosed
US-20030208002-A1 Toughened cyanoacrylate adhesives containing alkene-acrylate copolymers and method for production Henkel IP & Holding GmbH (DE) 2003-11-06 US disclosed
WO-2002000801-A1 TOUGHENED CYANOACRYLATE ADHESIVES CONTAINING ALKENE-ACRYLATE COPOLYMERS AND METHOD FOR PRODUCTION HENKEL LOCTITE CORPORATION (US) 2002-01-03 WO disclosed
US-5962703-A DENTAL ADHESIVE IVOCLAR AG (LI) 1999-10-05 US disclosed