Acrylamide

Acrylamide

SCHEMBL9229442

C1=Cc2cc3ccc(cc4nc(cc5ccc(cc1n2)[nH]5)C=C4)[nH]3.C=CC(N)=O.C=CC(N)=O.C=CC(N)=O.C=CC(N)=O

nearest known ligand 0.38

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Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ FGFR4 P22455 1/20 0.38
▸ STAT3 P40763 1/20 0.32
▸ STAT1 P42224 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
Carbamic Acid SCHEMBL30568294 0.85 STAT3 (0.38) TSHRSTAT3STAT1
Acrolein SCHEMBL5138989 0.80 STAT3 (0.34) ALDH1A1TSHRSTAT3STAT1
Acetone SCHEMBL29186682 0.80 STAT3 (0.36) ALDH1A1STAT3STAT1
SCHEMBL29430977 0.79 STAT3 (0.42) STAT3STAT1
SCHEMBL30821407 0.79 STAT3 (0.42) STAT3STAT1
SCHEMBL6744970 0.79 STAT3 (0.42) STAT3STAT1
SCHEMBL9404765 0.77 STAT3 (0.39) STAT3STAT1
SCHEMBL28742837 0.77 STAT3 (0.39) STAT3STAT1
SCHEMBL11339471 0.77 STAT3 (0.41) STAT3STAT1
SCHEMBL2495008 0.77 STAT3 (0.41) STAT3STAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5384397-A Tetraphenylporphyrin compounds and method THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1995-01-24 — — US claimed
WO-1994011371-A1 TETRAPHENYLPORPHYRIN COMPOUNDS AND METHOD THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1994-05-26 — — WO claimed
US-5274090-A Tetraphenylporphyrin compounds and method THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1993-12-28 — — US claimed
US-5384397-A Tetraphenylporphyrin compounds and method THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1995-01-24 — — US disclosed
WO-1994011371-A1 TETRAPHENYLPORPHYRIN COMPOUNDS AND METHOD THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1994-05-26 — — WO disclosed
US-5274090-A Tetraphenylporphyrin compounds and method THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1993-12-28 — — US disclosed
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