Acrylamide

Acrylamide

SCHEMBL7800898

C=CC(N)=O.O=C(O)OCC1CO1

nearest known ligand 0.47

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Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
TSHR P16473 1/20 0.39
FGFR4 P22455 1/20 0.39
MGLL Q99685 3/20 0.38

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
Acrylic Acid SCHEMBL31248113 0.89 ALDH1A1 (0.50) ALDH1A1TP53CYP3A4MGLL
Acrylic Acid SCHEMBL15421066 0.89 ALDH1A1 (0.50) ALDH1A1TP53CYP3A4MGLL
Acrylamide SCHEMBL10405369 0.86 ALDH1A1 (0.47) ALDH1A1TP53CYP3A4TSHRFGFR4
Propene SCHEMBL1151810 0.85 ALDH1A1 (0.55) ALDH1A1TP53CYP3A4MGLL
SCHEMBL27950232 0.84
SCHEMBL12189491 0.84
SCHEMBL377539 0.84
Acrylamide SCHEMBL28359256 0.83 ALDH1A1 (0.53) ALDH1A1TP53CYP3A4TSHRFGFR4
Methane SCHEMBL1903352 0.82
Acrylic Acid SCHEMBL15420073 0.82 ALDH1A1 (0.47) ALDH1A1TP53CYP3A4MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0951496-B1 ALKYD AND ARALKYD DERIVATIVES OF PHENOLIC POLYMERS GEORGIA PACIFIC RESINS (US) 2001-12-19 EP disclosed
EP-0951496-A2 ALKYD AND ARALKYD DERIVATIVES OF PHENOLIC POLYMERS GEORGIA-PACIFIC RESINS, INC. (US) 1999-10-27 EP disclosed
WO-1998030596-A2 ALKYD AND ARALKYD DERIVATIVES OF PHENOLIC POLYMERS GEORGIA-PACIFIC RESINS, INC. (US) 1998-07-16 WO disclosed
US-5770750-A Alkyd and aralkyd derivatives of phenolic polymers GEORGIA-PACIFIC RESINS, INC. (US) 1998-06-23 US disclosed