SCHEMBL12601445

SCHEMBL12601445

B[C@H]1CC(O)[C@@H](COC(c2ccccc2)(c2ccc(OC)cc2)c2ccc(OC)cc2)O1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TYMP P19971 4/20 0.44
SLC6A11 P48066 4/20 0.40
SLC6A1 P30531 2/20 0.40
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
SLC6A12 P48065 1/20 0.35
SLC6A13 Q9NSD5 1/20 0.35
KIF11 P52732 5/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL14062514 1.00 TYMP (0.44) TYMPSLC6A11SLC6A1MEN1KMT2A
SCHEMBL26077386 1.00 TYMP (0.44) TYMPSLC6A11SLC6A1MEN1KMT2A
SCHEMBL14063357 1.00 TYMP (0.44) TYMPSLC6A11SLC6A1MEN1KMT2A
SCHEMBL14062502 1.00 TYMP (0.44) TYMPSLC6A11SLC6A1MEN1KMT2A
SCHEMBL13255807 0.87 TYMP (0.45) TYMPSLC6A11SLC6A1MEN1KMT2A
SCHEMBL13329987 0.87 TYMP (0.45) TYMPSLC6A11SLC6A1MEN1KMT2A
SCHEMBL13374762 0.87 TYMP (0.45) TYMPSLC6A11SLC6A1MEN1KMT2A
SCHEMBL10423328 0.86 TYMP (0.44) TYMPSLC6A11SLC6A1MEN1KMT2A
SCHEMBL9212681 0.86 TYMP (0.44) TYMPSLC6A11SLC6A1MEN1KMT2A
SCHEMBL14387754 0.86 TYMP (0.41) TYMPSLC6A11SLC6A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7943758-B2 3′-end nucleoside unit comprising phosphoramidite JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-05-17 US disclosed
US-20080221303-A1 Method for the Preparation of Peptide-Oligonucleotide Conjugates FRUTAROM LTD. (IL) 2008-09-11 US disclosed
US-20080039620-A1 3'-End Nucleoside Unit Comprising Phosphoramidite JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2008-02-14 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-20080221303-A1 Method for the Preparation of Peptide-Oligonucleotide Conjugates VIP, PTMS, SSTR4 TYMP 232/4885SLC6A11 4171/4885SLC6A1 4285/4885
US-20080039620-A1 3'-End Nucleoside Unit Comprising Phosphoramidite POLR2H, POLN, RNGTT TYMP 38/4885SLC6A11 4667/4885SLC6A1 4642/4885

“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.