SCHEMBL5662499

SCHEMBL5662499

COc1cc(CC(P(=O)(OC(C)C)OC(C)C)P(=O)(OC(C)C)OC(C)C)cc(OC)c1O

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 17/20 0.63
MAPT P10636 1/20 0.46
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL7521560 0.86 HMGCR (0.57) HMGCRMAPT
SCHEMBL7083289 0.80 HMGCR (0.65) HMGCR
Apomine SCHEMBL1648488 0.78 HMGCR (1.00) HMGCR
SCHEMBL7080284 0.77 HMGCR (0.60) HMGCR
SCHEMBL6370450 0.76 HMGCR (0.54) HMGCR
SCHEMBL5662316 0.75 FDPS (0.43) HMGCRMAPTCYP1A2CYP2C19NPSR1
SCHEMBL624795 0.75 FOS (0.50) MAPTKMT2A
SCHEMBL6320488 0.74 L3MBTL1 (0.42) HMGCRMAPTCYP1A2CYP2C9CYP2C19
SCHEMBL21074678 0.74 HMGCR (0.57) HMGCR
SCHEMBL7521921 0.73 HMGCR (0.50) HMGCRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1482954-A4 ALPHA-SUBSTITUTED ARYLALKYL PHOSPHONATE DERIVATIVES ILEX PRODUCTS INC (US) 2006-05-03 EP disclosed
US-20050124586-A1 Alpha-substituted arylalkyl phosphonate derivatives ILEX PRODUCTS, INC. 2005-06-09 US disclosed
EP-1482954-A2 ALPHA-SUBSTITUTED ARYLALKYL PHOSPHONATE DERIVATIVES Ilex Products, Inc. (US) 2004-12-08 EP disclosed
WO-2003069302-A2 ALPHA-SUBSTITUTED ARYLALKYL PHOSPHONATE DERIVATIVES ILEX PRODUCTS, INC. (US) 2003-08-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050124586-A1 Alpha-substituted arylalkyl phosphonate derivatives APOB, APOL1, LDLR HMGCR 117/4885MAPT 4229/4885CYP1A2 1901/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.