SCHEMBL10885668

SCHEMBL10885668

N#CC(=CCCO)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.37
KDM4E B2RXH2 2/20 0.37
CISD1 Q9NZ45 1/20 0.37
SLC16A3 O15427 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
SLC16A1 P53985 1/20 0.37
GPR35 Q9HC97 1/20 0.37

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
SCHEMBL27880894 1.00 EGFR (0.37) EGFRKDM4ECISD1SLC16A3ALDH1A1
SCHEMBL4001965 0.87 EGFR (0.35) EGFRKDM4ECISD1SLC16A3ALDH1A1
SCHEMBL9639817 0.81
SCHEMBL4450663 0.81
Ethylene Glycol SCHEMBL27681734 0.81 EP300 (0.43) SLC16A3SLC16A1
SCHEMBL7565234 0.80 GRIK1 (0.39) EGFRKDM4ECISD1SLC16A3ALDH1A1
SCHEMBL450840 0.80 EGFR (0.36) EGFRKDM4ECISD1SLC16A3ALDH1A1
SCHEMBL5109758 0.80 GRIK1 (0.39) EGFRKDM4ECISD1SLC16A3ALDH1A1
SCHEMBL148172 0.80 GRIK1 (0.39) EGFRKDM4ECISD1SLC16A3ALDH1A1
Ethylene Glycol SCHEMBL27681733 0.78 CISD1 (0.35) EGFRKDM4ECISD1SLC16A3ALDH1A1

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-4431790-A REACTION PRODUCT OF POLYOXYALKYLENEPOLYAMINE, HYDROXY-ACRYLIC DERIVATIVE, EPOXIDE TEXACO INC. (US) 1984-02-14 US claimed
CN-103476885-B Cyanoacrylate adhesive with improved water resistance HENKEL IP HOLDING LTD 2015-06-10 CN disclosed
CN-103476885-A Cyanoacrylate adhesive with improved water resistance HENKEL IRELAND LTD 2013-12-25 CN disclosed
EP-0046088-B1 POLYALKYLENEPOLYAMINE DERIVATIVES AND THEIR USE AS CURING AGENTS FOR POLYURETHANES TEXACO DEVELOPMENT CORPORATION (US) 1986-12-30 EP disclosed
US-4431790-A REACTION PRODUCT OF POLYOXYALKYLENEPOLYAMINE, HYDROXY-ACRYLIC DERIVATIVE, EPOXIDE TEXACO INC. (US) 1984-02-14 US disclosed
EP-0046088-A1 Polyalkylenepolyamine derivatives and their use as curing agents for polyurethanes TEXACO DEVELOPMENT CORPORATION (US) 1982-02-17 EP disclosed