SCHEMBL133759

SCHEMBL133759

COc1ccc(C(OC[C@@]23CO[C@@H]([C@H](c4ccc5ccc6cccc7ccc4c5c67)O2)[C@@H]3O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A1 P30531 2/20 0.33
SLC6A11 P48066 1/20 0.33
TP53 P04637 1/20 0.31
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 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
SCHEMBL6277830 1.00 SLC6A1 (0.33) SLC6A1SLC6A11TP53NPC1ALDH1A1
SCHEMBL169480 0.90 EGFR (0.35) SLC6A1SLC6A11NPC1ALDH1A1
SCHEMBL169481 0.90 EGFR (0.35) SLC6A1SLC6A11NPC1ALDH1A1
SCHEMBL132699 0.83 SLC6A11 (0.38) SLC6A1SLC6A11TP53LMNAHTT
SCHEMBL135522 0.82 SLC6A11 (0.35) SLC6A1SLC6A11TP53LMNA
SCHEMBL134065 0.78
SCHEMBL134066 0.78
SCHEMBL169678 0.75 SLC5A2 (0.36) SLC6A1SLC6A11LMNAMAPTHTT
SCHEMBL169679 0.75 SLC5A2 (0.36) SLC6A1SLC6A11LMNAMAPTHTT
SCHEMBL6880054 0.75 SLC5A2 (0.36) SLC6A1SLC6A11LMNAMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9464106-B2 Oligonucleotides useful for detecting and analyzing nucleic acids of interest EXIQON A/S (DK) 2016-10-11 US disclosed
US-20120157333-A1 OLIGONUCLEOTIDES USEFUL FOR DETECTING AND ANALYZING NUCLEIC ACIDS OF INTEREST EXIQON A/S (DK) 2012-06-21 US disclosed
EP-1446412-B1 NOVEL LNA COMPOSITIONS AND USES THEREOF EXIQON AS (DK) 2012-03-07 EP disclosed
US-20070117144-A1 Oligonucleotides useful for detecting and analyzing nucleic acids of interest EXIQON A/S (DK) 2007-05-24 US disclosed
US-7060809-B2 LNA compositions and uses thereof EXIQON A/S (DE) 2006-06-13 US disclosed
US-20030224377-A1 Novel LNA compositions and uses thereof QIAGEN GMBH (DE) 2003-12-04 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 (2 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-20030224377-A1 Novel LNA compositions and uses thereof RNGTT, NCL, NSUN2 SLC6A1 2880/4885SLC6A11 2707/4885TP53 613/4885
US-20120157333-A1 OLIGONUCLEOTIDES USEFUL FOR DETECTING AND ANALYZING NUCLEIC ACIDS OF INTEREST UPF1, DCLRE1B, SNRPA1 SLC6A1 4477/4885SLC6A11 4253/4885TP53 103/4885

“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.