SCHEMBL6669134

SCHEMBL6669134

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.39
DNM1 Q05193 3/20 0.36
TP53 P04637 3/20 0.35
MAPT P10636 4/20 0.34
ALDH1A1 P00352 5/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PTP4A1 Q93096 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MIF P14174 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NPC1 O15118 1/20 0.32
USP2 O75604 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 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
SCHEMBL6665621 0.89 CYP2C9 (0.37) CYP2C9DNM1TP53MAPTALDH1A1
SCHEMBL6665379 0.88 CYP2C9 (0.41) CYP2C9DNM1MAPTALDH1A1LMNA
SCHEMBL6663364 0.86 CYP2C9 (0.35) CYP2C9DNM1TP53MAPTALDH1A1
SCHEMBL7150495 0.86 TP53 (0.34) CYP2C9TP53MAPTRXFP1
SCHEMBL24755221 0.79 CYP2C9 (0.46) CYP2C9DNM1TP53MAPTALDH1A1
SCHEMBL28634345 0.78 THRB (0.47) CYP2C9DNM1TP53MAPTALDH1A1
SCHEMBL7548113 0.76 ALDH1A1 (0.46) CYP2C9TP53MAPTALDH1A1LMNA
SCHEMBL7737784 0.76 TP53 (0.46) CYP2C9DNM1TP53MAPTALDH1A1
SCHEMBL7745769 0.76 ALDH1A1 (0.46) CYP2C9TP53MAPTALDH1A1LMNA
SCHEMBL7737783 0.76 TP53 (0.46) CYP2C9DNM1TP53MAPTALDH1A1

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 8 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
WO-2004024467-A2 SURFACE-MOUNTING SYSTEM LOCTITE (R & D) LIMITED (IE) 2004-03-25 WO 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