SCHEMBL5080166

SCHEMBL5080166

C=COC(=O)OC1CCCCC1OC(=O)OC=C

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 2/20 0.35

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
SCHEMBL28417901 0.88 GSR (0.39)
SCHEMBL319201 0.81 EPHX1 (0.42)
SCHEMBL5083948 0.77 SERPINE1 (0.31) SERPINE1
SCHEMBL5081625 0.75 SERPINE1 (0.39) SERPINE1
SCHEMBL6354185 0.74 MEN1 (0.33)
SCHEMBL7025388 0.74 ATM (0.53)
SCHEMBL10750894 0.73 SERPINE1 (0.37) SERPINE1
SCHEMBL2326669 0.72 ALDH1A1 (0.44) SERPINE1
SCHEMBL1080565 0.70 SERPINE1 (0.38) SERPINE1
SCHEMBL15081544 0.70 KDM4E (0.32) SERPINE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1954666-A1 PROCESS FOR PREPARING VINYL CARBOXYLATES BASF SE (DE) 2008-08-13 EP claimed
WO-2007060176-A1 PROCESS FOR PREPARING VINYL CARBOXYLATES BASF SE (DE) 2007-05-31 WO claimed