SCHEMBL19904746

SCHEMBL19904746

CCCCOP(=O)(Oc1ccccc1Cl)Oc1ccc(CCCCOP(=O)(Oc2ccc(Cl)cc2Cl)Oc2ccc(Cl)cc2Cl)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.50
GAA P10253 1/20 0.47
MAPK1 P28482 1/20 0.47
PKM P14618 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
GLA P06280 1/20 0.43
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.39
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL30722914 0.85 GAA (0.56) L3MBTL1GAAMAPK1SMN1; SMN2TDP1
SCHEMBL3230831 0.85 GAA (0.56) L3MBTL1GAAMAPK1SMN1; SMN2TDP1
SCHEMBL3228871 0.83 GAA (0.56) L3MBTL1GAAMAPK1SMN1; SMN2TDP1
SCHEMBL3238027 0.82 PKM (0.51) L3MBTL1PKMSMN1; SMN2LMNA
SCHEMBL19904719 0.80 GLA (0.41) L3MBTL1PKMSMN1; SMN2GLATDP1
SCHEMBL20067126 0.80 L3MBTL1 (0.51) L3MBTL1PKMSMN1; SMN2LMNA
SCHEMBL30722828 0.80 PKM (0.51) L3MBTL1PKMSMN1; SMN2LMNA
SCHEMBL3222691 0.80 PKM (0.51) L3MBTL1PKMSMN1; SMN2LMNA
SCHEMBL3224957 0.79 L3MBTL1 (0.52) L3MBTL1PKMSMN1; SMN2LMNA
SCHEMBL19904757 0.79 GAA (0.43) L3MBTL1GAAMAPK1SMN1; SMN2GLA

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