SCHEMBL13460348

SCHEMBL13460348

COc1ccc(COCCC(COC(c2ccccc2)(c2ccccc2)c2ccccc2)OCCO)cc1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 6/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
SLC6A1 P30531 2/20 0.36
SLC6A11 P48066 1/20 0.36
TBXAS1 P24557 6/20 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
SCHEMBL13377805 1.00 CHRM3 (0.42) CHRM3L3MBTL1TDP1CA1CA2
SCHEMBL13377795 0.89 CA1 (0.41) CHRM3L3MBTL1TDP1CA1CA2
SCHEMBL13377618 0.87 L3MBTL1 (0.41) CHRM3L3MBTL1TDP1SLC6A1SLC6A11
SCHEMBL2769219 0.85 L3MBTL1 (0.40) CHRM3L3MBTL1TDP1CA1CA2
SCHEMBL2769924 0.85 L3MBTL1 (0.42) CHRM3L3MBTL1TDP1CA1CA2
SCHEMBL2771845 0.83 CA1 (0.48) CHRM3L3MBTL1TDP1CA1CA2
SCHEMBL24763738 0.81 CHRM3 (0.41) CHRM3L3MBTL1TDP1SLC6A1SLC6A11
SCHEMBL4184119 0.81 NAAA (0.38) CHRM3CA1CA2
SCHEMBL4184115 0.81 NAAA (0.38) CHRM3CA1CA2
SCHEMBL4192567 0.80 DUT (0.39) CHRM3CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7683164-B2 Nucleic acid derivatives BIO-RAD LABORATORIES INC. (US) 2010-03-23 US disclosed
US-20090005334-A1 cyclic moieties which enable the formation of stable hybrids with natural nucleic acids and can therefore be efficiently used in a wide variety of applications and, in particular, in antisense therapy BIO-RAD LABORATORIES INC. (US) 2009-01-01 US 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-20090005334-A1 cyclic moieties which enable the formation of stable hybrids with natural nucleic acids and can therefore be efficiently used in a wide variety of applications and, in particular, in antisense therapy POLRMT, NSUN2, RNGTT CHRM3 3806/4885L3MBTL1 117/4885TDP1 848/4885

“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.