SCHEMBL22337030

SCHEMBL22337030

C=C1OCC(COC(=O)C/C=C/C)O1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 0.34
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MGLL Q99685 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
SCHEMBL11519241 0.79 ALDH1A1 (0.47) LMNAPOLBALDH1A1MGLL
SCHEMBL9418476 0.79 ALDH1A1 (0.47) LMNAPOLBALDH1A1MGLL
SCHEMBL13298654 0.77 ALDH1A1 (0.42) LMNAALDH1A1
SCHEMBL25848491 0.77 LPAR1 (0.39) LPAR1LMNAPOLB
SCHEMBL12134668 0.75 ALDH1A1 (0.37) ALDH1A1
SCHEMBL22337033 0.75 L3MBTL1 (0.35) LPAR1LMNAPOLBMGLL
SCHEMBL23586316 0.74 ALDH1A1 (0.63) ALDH1A1
SCHEMBL20752877 0.71 ALDH1A1 (0.42) ALDH1A1
SCHEMBL12134670 0.71 L3MBTL1 (0.34) ALDH1A1
SCHEMBL25147609 0.70 HMGCR (0.34) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200255587-A1 LIQUID HYDROCARBON-BASED COPOLYMERS BEARING TWO CYCLOCARBONATE ESTER END GROUPS BOSTIK SA (FR) 2020-08-13 US disclosed