SCHEMBL261307

SCHEMBL261307

C=C/C=C\C(=C)C(=O)C(=O)O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.30

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
SCHEMBL258264 0.84
SCHEMBL27545171 0.82 LMNA (0.32) LMNA
Water SCHEMBL3344918 0.82 LMNA (0.32) LMNA
SCHEMBL17578579 0.81 TRPA1 (0.31)
SCHEMBL14342061 0.78 ALDH1A1 (0.33)
Methacrylic Acid SCHEMBL28032812 0.76 ALDH1A1 (0.32)
SCHEMBL27855091 0.75 LMNA (0.30) LMNA
SCHEMBL18808343 0.75 LMNA (0.30) LMNA
SCHEMBL22954103 0.74
Acrylonitrile SCHEMBL22418820 0.73 ALDH1A1 (0.38)

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
US-8778642-B2 Biological synthesis of difunctional alkanes from carbohydrate feedstocks CELEXION, LLC (US) 2014-07-15 US disclosed
US-20120258504-A1 BIOLOGICAL SYNTHESIS OF DIFUNCTIONAL ALKANES FROM CARBOHYDRATE FEEDSTOCKS CELEXION, LLC (US) 2012-10-11 US disclosed
US-8133704-B2 Biological synthesis of difunctional alkanes from carbohydrate feedstocks CELEXION, LLC (US) 2012-03-13 US disclosed