SCHEMBL3371887

SCHEMBL3371887

O=C(O)C[C@@H](O)C[C@H](O)CCl

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.57
GABRR1 P24046 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.40
GPR84 Q9NQS5 4/20 0.39
TSHR P16473 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP12 P39900 1/20 0.32
MMP13 P45452 1/20 0.32
MMP14 P50281 1/20 0.32
HMGCR P04035 1/20 0.32

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
SCHEMBL8893904 1.00 SLC22A6 (0.57) SLC22A6GABRR1LMNAMAPTSMN1; SMN2
SCHEMBL2227091 1.00 SLC22A6 (0.57) SLC22A6GABRR1LMNAMAPTSMN1; SMN2
SCHEMBL17204173 1.00 SLC22A6 (0.57) SLC22A6GABRR1LMNAMAPTSMN1; SMN2
SCHEMBL1135965 1.00 SLC22A6 (0.57) SLC22A6GABRR1LMNAMAPTSMN1; SMN2
SCHEMBL30641549 1.00 SLC22A6 (0.57) SLC22A6GABRR1LMNAMAPTSMN1; SMN2
SCHEMBL30972500 0.87
SCHEMBL374298 0.87
SCHEMBL1405707 0.87
SCHEMBL2687087 0.87
SCHEMBL6453593 0.87 SLC22A6 (0.75) SLC22A6GABRR1LMNAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1619191-B1 Process for producing optically active 2-[6-(hydroxymethyl)-1,3-dioxan-4-yl] acetic acid derivatives KANEKA CORP (JP) 2010-10-27 EP disclosed
EP-1394157-B1 Process for the preparation of 3,5-dihydroxy substituted esters as intermediates for producing optically active 2-(6-(hydroxymethyl)-1,3-dioxan-4-yl) acetic acid dervatives KANEKA CORP (JP) 2007-10-17 EP disclosed
EP-1619191-A2 Process for producing optically active 2-[6-(hydroxymethyl)-1,3-dioxan-4-yl] acetic acid derivatives KANEKA CORPORATION (JP) 2006-01-25 EP disclosed
US-6903225-B2 Process for producing optically active 2-[6-(hydroxymethyl)-1,3-dioxan-4-yl]acetic acid derivatives KANEKA CORPORATION (JP) 2005-06-07 US disclosed
EP-1024139-B1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE 2-(6-(HYDROXYMETHYL)-1,3-DIOXAN-4-YL) ACETIC ACID DERIVATIVES KANEKA CORP (JP) 2004-05-12 EP disclosed
EP-1394157-A2 Process for the preparation of 3,5-dihydroxy substituted esters as intermediates for producing optically active 2-(6-(hydroxymethyl)-1,3-dioxan-4-yl) acetic acid dervatives KANEKA CORPORATION (JP) 2004-03-03 EP disclosed
US-20030040634-A1 Process for producing optically active 2-[6-(hydroxymethyl)-1,3-dioxan-4yl]acetic acid derivatives KANEKA CORPORATION (JP) 2003-02-27 US disclosed
US-6472544-B1 REACTING ACETIC ACID DERIVATIVE WITH AN ENOLATE, REDUCING WITH A MICROORGANISM, ACETALIZING IN PRESENCE OF ACID CATALYST THEN ALKALINE SAPONIFICATION; NO SPECIAL EQUIPMENT OR SUPER LOW TEMPERATURE REQUIRED; INEXPENSIVE STARTING MATERIALS KANEKA CORPORATION (JP) 2002-10-29 US disclosed
EP-1024139-A1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE 2- 6-(HYDROXYMETHYL)-1,3-DIOXAN-4-YL]ACETIC ACID DERIVATIVES KANEKA CORPORATION (JP) 2000-08-02 EP 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-20030040634-A1 Process for producing optically active 2-[6-(hydroxymethyl)-1,3-dioxan-4yl]acetic acid derivatives HAAO, APEH, AADAC SLC22A6 2542/4885GABRR1 2963/4885LMNA 2150/4885

“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.