SCHEMBL8625401

SCHEMBL8625401

CCOP(=O)(OCC)C(CCC(CCCc1ccccc1)c1ccccc1)S(=O)(=O)O

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
FDFT1 P37268 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ACP3 P15309 1/20 0.36
GAA P10253 1/20 0.36
KDM4E B2RXH2 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
SCHEMBL8619968 0.91 POLB (0.47) POLBALDH1A1LMNAFDFT1MEN1
SCHEMBL8625395 0.88 POLB (0.44) POLBFDFT1MEN1KMT2AGAA
SCHEMBL8620515 0.87 POLB (0.46) POLBALDH1A1LMNAMAPTKDM4E
SCHEMBL8618661 0.87 POLB (0.48) POLBALDH1A1LMNAMAPTMEN1
SCHEMBL8618653 0.86 FDFT1 (0.44) POLBFDFT1MEN1KMT2AGAA
SCHEMBL8619955 0.83 FDFT1 (0.53) POLBFDFT1
SCHEMBL8621511 0.83 ACP3 (0.48) FDFT1ACP3
SCHEMBL8624038 0.81 FDFT1 (0.57) POLBFDFT1
SCHEMBL8623402 0.81 POLB (0.44) POLBALDH1A1LMNAMAPTMEN1
SCHEMBL8623396 0.81 FFAR1 (0.45) FDFT1MEN1KMT2A

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-5712396-A PHOSPHONOSULFONATE COMPOUNDS USED FOR INHIBITING CHOLESTEROL BIOSYNTHESIS AND ATHEROSCLEROSIS MAGNIN DAVID R (US) 1998-01-27 US disclosed
US-5567841-A ANTICHOLESTEROL AGENT BRISTOL-MYERS SQUIBB COMPANY (US) 1996-10-22 US disclosed
US-5470845-A Methods of using α-phosphonosulfonate squalene synthetase inhibitors including the treatment of atherosclerosis and hypercholesterolemia BRISTOL-MYERS SQUIBB COMPANY (US) 1995-11-28 US disclosed