SCHEMBL19904708

SCHEMBL19904708

CCCOP(=O)(OCCC)Oc1ccc(CCOP(=O)(OCC)Oc2ccccc2Cl)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
CSNK2A1 P68400 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
GLA P06280 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.38
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL3222660 0.83 LMNA (0.51) PKML3MBTL1SMN1; SMN2LMNAALDH1A1
SCHEMBL32660807 0.83 LMNA (0.51) PKML3MBTL1SMN1; SMN2LMNAALDH1A1
SCHEMBL3225021 0.81 LMNA (0.55) PKML3MBTL1SMN1; SMN2TDP1LMNA
SCHEMBL19904763 0.79 PKM (0.49) PKML3MBTL1SMN1; SMN2LMNA
SCHEMBL19904746 0.78 L3MBTL1 (0.50) PKML3MBTL1SMN1; SMN2GLATDP1
SCHEMBL30722828 0.76 PKM (0.51) PKML3MBTL1SMN1; SMN2LMNA
SCHEMBL3222691 0.76 PKM (0.51) PKML3MBTL1SMN1; SMN2LMNA
SCHEMBL3224957 0.74 L3MBTL1 (0.52) PKML3MBTL1SMN1; SMN2LMNA
SCHEMBL13430890 0.74 LMNA (0.42) PKML3MBTL1SMN1; SMN2LMNAALDH1A1
SCHEMBL3238027 0.73 PKM (0.51) PKML3MBTL1SMN1; SMN2LMNA

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
EP-2097428-B1 BUTYRYLCHOLINESTERASE INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES MGP BIOTECHNOLOGIES INC (US) 2018-02-28 EP disclosed