SCHEMBL22129641

SCHEMBL22129641

C=C(C#N)C(=O)O.CCCCCCCCC=C(C#N)C(=O)OCCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.41
TSHR P16473 3/20 0.39
ALDH1A1 P00352 1/20 0.38
CYP2C9 P11712 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
CYP3A4 P08684 1/20 0.35
GAA P10253 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
TP53 P04637 1/20 0.34
PPARG P37231 7/20 0.33
PPARA Q07869 2/20 0.33
TRPA1 O75762 1/20 0.33
FBP1 P09467 1/20 0.33
FAAH O00519 2/20 0.33
HCAR2 Q8TDS4 1/20 0.32

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
SCHEMBL29026257 0.95 TSHR (0.42) EP300TSHRALDH1A1CYP2C9MEN1
SCHEMBL1973732 0.85 EP300 (0.49) EP300CYP2C9LMNAPOLBMAPT
SCHEMBL7745806 0.84 TSHR (0.44) EP300TSHRALDH1A1CYP2C9MEN1
SCHEMBL7743277 0.84 TSHR (0.44) EP300TSHRALDH1A1CYP2C9MEN1
SCHEMBL13703525 0.84 TSHR (0.47) EP300TSHRCYP2C9MEN1LMNA
SCHEMBL20472622 0.84 TSHR (0.47) EP300TSHRCYP2C9MEN1LMNA
SCHEMBL7745807 0.84 TSHR (0.44) EP300TSHRALDH1A1CYP2C9MEN1
SCHEMBL7743274 0.84 TSHR (0.44) EP300TSHRALDH1A1CYP2C9MEN1
SCHEMBL20472626 0.84 TSHR (0.47) EP300TSHRCYP2C9MEN1LMNA
SCHEMBL7743058 0.82 TP53 (0.44) EP300TSHRALDH1A1CYP2C9MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3898736-A1 COMPOSITION COMPRISING CYANOACRYLATES AND AT LEAST ONE BLOCK COPOLYMER ARKEMA FRANCE (FR) 2021-10-27 EP claimed
WO-2020128349-A1 COMPOSITION COMPRISING CYANOACRYLATES AND AT LEAST ONE BLOCK COPOLYMER ARKEMA FRANCE (FR) 2020-06-25 WO claimed