Acrylamide

Acrylamide

SCHEMBL8777767

C=C(C)C(=O)OC.C=CC#N.C=CC(N)=O.C=CC=C

nearest known ligand 0.50

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Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
TSHR P16473 3/20 0.37
FGFR4 P22455 1/20 0.37
TDP1 Q9NUW8 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
Acrylonitrile SCHEMBL1898906 0.91 ALDH1A1 (0.60) ALDH1A1TSHR
Acrylonitrile SCHEMBL5382420 0.88 ALDH1A1 (0.65) ALDH1A1TSHRTDP1
Acrylonitrile SCHEMBL10915301 0.88 ALDH1A1 (0.65) ALDH1A1TSHRTDP1
Acrylonitrile SCHEMBL180070 0.88 ALDH1A1 (0.65) ALDH1A1TSHRTDP1
Acrylamide SCHEMBL28522575 0.86 ALDH1A1 (0.54) ALDH1A1TSHRFGFR4TDP1
Benzene SCHEMBL28123113 0.86 ALDH1A1 (0.54) ALDH1A1TSHR
Methacrylic Acid SCHEMBL16779946 0.86 ALDH1A1 (0.54) ALDH1A1TSHR
Acrylonitrile SCHEMBL19515135 0.86 ALDH1A1 (0.58) ALDH1A1TSHR
Acrylonitrile SCHEMBL28123871 0.86 ALDH1A1 (0.62) ALDH1A1TSHR
Acrylamide SCHEMBL36512 0.86 ALDH1A1 (0.68) ALDH1A1TSHRFGFR4TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0587139-B1 Heat-sensitive recording sheet MITSUBISHI PAPER MILLS LTD (JP) 1997-12-29 EP disclosed
US-5427996-A Protective surface layer composed of latex; chemical, water resistant, storage stability MITSUBISHI PAPER MILLS LIMITED (JP) 1995-06-27 US disclosed
EP-0587139-A2 Heat-sensitive recording sheet MITSUBISHI PAPER MILLS, LTD. (JP) 1994-03-16 EP disclosed