SCHEMBL7150495

SCHEMBL7150495

CCC=C(C#N)C(=O)OOCCOC(C)CC

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.34
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL7168426 0.89 CYP2C9 (0.30) CYP2C9
SCHEMBL7144810 0.87 EPHX2 (0.31)
SCHEMBL6669134 0.86 CYP2C9 (0.39) TP53MAPTCYP2C9RXFP1
SCHEMBL5561659 0.81 CYP2C9 (0.35) CYP2C9
SCHEMBL29372513 0.81 CYP2C9 (0.37) MAPTCYP2C9
SCHEMBL5555817 0.80 CYP2C9 (0.37) MAPTCYP2C9
SCHEMBL5555156 0.78 CYP2C9 (0.33) CYP2C9
SCHEMBL5560108 0.77 CYP2C9 (0.33) CYP2C9
SCHEMBL668298 0.77 CYP2C9 (0.42) MAPTCYP2C9
SCHEMBL15924890 0.77 CYP2C9 (0.34) TP53MAPTCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9752049-B2 Optically transparent, superhydrophobic, biocompatible thin film coatings and methods for producing same UT-BATTELLE, LLC (US) 2017-09-05 US claimed
EP-1360257-A1 CYANOACRYLATE COMPOSITIONS CURABLE TO FLEXIBLE POLYMERIC MATERIALS Loctite (R & D) Limited (IE) 2003-11-12 EP claimed
WO-2002053666-A1 CYANOACRYLATE COMPOSITIONS CURABLE TO FLEXIBLE POLYMERIC MATERIALS LOCTITE (R & D) LIMITED (IE) 2002-07-11 WO claimed
EP-2999689-A1 CYANOACRYLATE COMPOSITIONS Henkel IP & Holding GmbH (DE) 2016-03-30 EP disclosed
WO-2014189938-A1 CYANOACRYLATE COMPOSITIONS Henkel US IP LLC (US) 2014-11-27 WO disclosed
EP-1360257-A1 CYANOACRYLATE COMPOSITIONS CURABLE TO FLEXIBLE POLYMERIC MATERIALS Loctite (R & D) Limited (IE) 2003-11-12 EP disclosed
WO-2002053666-A1 CYANOACRYLATE COMPOSITIONS CURABLE TO FLEXIBLE POLYMERIC MATERIALS LOCTITE (R & D) LIMITED (IE) 2002-07-11 WO disclosed