SCHEMBL6016826

SCHEMBL6016826

CC(C)OP(=O)(OC(C)C)C(CC(=O)ON1C(=O)CCC1=O)P(=O)(OC(C)C)OC(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.33
POLB P06746 1/20 0.31
MGLL Q99685 1/20 0.31
KMT2A Q03164 1/20 0.30
ATM Q13315 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
SCHEMBL4260252 0.82 HMGCR (0.33) HMGCRPOLBKMT2AATM
SCHEMBL15970638 0.79 KDM4E (0.31) POLB
SCHEMBL15643139 0.77 KMT2A (0.36) MGLLKMT2AATM
SCHEMBL1245548 0.77 MMP1 (0.36) MGLLKMT2AATM
SCHEMBL15970691 0.77 CTSA (0.31) POLBMGLL
SCHEMBL17155176 0.76 MAPK1 (0.35) MGLLKMT2AATM
SCHEMBL16310469 0.74 KMT2A (0.37) MGLLKMT2AATM
SCHEMBL19704975 0.74 MGLL (0.35) MGLLKMT2AATM
SCHEMBL11267463 0.74 KMT2A (0.34) MGLLKMT2AATM
SCHEMBL12741112 0.73 ELANE (0.37) MGLLKMT2AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1239886-B1 LABELLED ASCORBIC ACID DERIVATIVES GE HEALTHCARE LTD (GB) 2006-11-29 EP disclosed
US-6749832-B2 DIAGNOSIS, PROGNOSIS AND RADIOTHERAPY OF METASTATIC BONE DISEASE; SUCH AS TAGGED 5-(2-AMINO-1-HYDROXYETHYL)-3,4-DIBENZYLOXY-5H-FURAN-2-ONE AMERSHAM PLC (GB) 2004-06-15 US disclosed
US-20030153736-A1 Labelled ascorbic acid derivatives GE HEALTHCARE LIMITED (GB) 2003-08-14 US disclosed
EP-1239886-A2 LABELLED ASCORBIC ACID DERIVATIVES GE Healthcare Limited (GB) 2002-09-18 EP disclosed
WO-2001047564-A2 LABELLED ASCORBIC ACID DERIVATIVES AMERSHAM PLC (GB) 2001-07-05 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-20030153736-A1 Labelled ascorbic acid derivatives CYP27B1, CYP24A1, XDH HMGCR 240/4885POLB 2675/4885MGLL 4630/4885

“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.