SCHEMBL8906227

SCHEMBL8906227

C=CCOC(CC=C)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 2/20 0.31
PDE4A P27815 1/20 0.31
MGAM O43451 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
SCHEMBL87985 0.85 CA1 (0.31)
SCHEMBL3290501 0.81 CA1 (0.42) TDP1LMNAL3MBTL1
SCHEMBL11766137 0.81 CA1 (0.42) TDP1LMNAL3MBTL1
SCHEMBL23045157 0.81 CA1 (0.42) TDP1LMNAL3MBTL1
SCHEMBL11059354 0.79 TDP1 (0.48) TDP1LMNAL3MBTL1KDM4EPDE4A
SCHEMBL657953 0.79 TDP1 (0.48) TDP1LMNAL3MBTL1KDM4EPDE4A
SCHEMBL15319451 0.78 CA1 (0.34)
SCHEMBL22495180 0.77 CA1 (0.33) TDP1LMNAL3MBTL1
SCHEMBL28112050 0.76 TDP1 (0.44) TDP1LMNAL3MBTL1KDM4EPDE4A
SCHEMBL1589961 0.76 TDP1 (0.60) TDP1LMNAL3MBTL1KDM4EPDE4A

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-5653886-A CROSSLINKED DIALLYLDIMETHYL AMMONIUM CHLORIDE POLYMERS IN WATER-IN-OIL EMULSION FORM NALCO CHEMICAL COMPANY (US) 1997-08-05 US disclosed
US-5518634-A DEWATERING NALCO CHEMICAL COMPANY (US) 1996-05-21 US disclosed
US-3968037-A DIALLYL DIMETHYL AMMONIUM CHLORIDE COPOLYMER, TREATMENT OF ACTIVATED SEWAGE SLUDGE CALGON CORPORATION (US) 1976-07-06 US disclosed