SCHEMBL13010077

SCHEMBL13010077

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

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TYMP P19971 4/20 0.41
SLC6A11 P48066 7/20 0.38
SLC6A1 P30531 3/20 0.38
SLC6A12 P48065 2/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
KMT2A Q03164 1/20 0.34
SLC6A13 Q9NSD5 1/20 0.34
KIF11 P52732 1/20 0.31
KCNH2 Q12809 1/20 0.31
DRD2 P14416 1/20 0.31
OPRM1 P35372 1/20 0.31
DRD3 P35462 1/20 0.31

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
SCHEMBL15338547 1.00 TYMP (0.41) TYMPSLC6A11SLC6A1SLC6A12MEN1
SCHEMBL9208332 0.86 TYMP (0.44) TYMPSLC6A11SLC6A1SLC6A12MEN1
SCHEMBL10423328 0.86 TYMP (0.44) TYMPSLC6A11SLC6A1SLC6A12MEN1
SCHEMBL9212681 0.86 TYMP (0.44) TYMPSLC6A11SLC6A1SLC6A12MEN1
SCHEMBL13329987 0.81 TYMP (0.45) TYMPSLC6A11SLC6A1SLC6A12MEN1
SCHEMBL13255807 0.81 TYMP (0.45) TYMPSLC6A11SLC6A1SLC6A12MEN1
SCHEMBL13374762 0.81 TYMP (0.45) TYMPSLC6A11SLC6A1SLC6A12MEN1
SCHEMBL13190443 0.81 SLC6A11 (0.40) TYMPSLC6A11SLC6A1SLC6A12MEN1
SCHEMBL12601445 0.80 TYMP (0.44) TYMPSLC6A11SLC6A1SLC6A12MEN1
SCHEMBL14062514 0.80 TYMP (0.44) TYMPSLC6A11SLC6A1SLC6A12MEN1

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-20100317714-A1 COMPLEX MOLECULE INTERFERING THE EXPRESSION OF TARGET GENES AND ITS PREPARING METHODS SUZHOU RIBO LIFE SCIENCE CO., LTD (CN) 2010-12-16 US disclosed
US-20100317714-A1 COMPLEX MOLECULE INTERFERING THE EXPRESSION OF TARGET GENES AND ITS PREPARING METHODS SUZHOU RIBO LIFE SCIENCE CO., LTD (CN) 2010-12-16 US disclosed
EP-2233573-A1 A COMPLEX MOLECULE INTERFERING THE EXPRESSION OF TARGET GENES AND ITS PREPARING METHODS Suzhou Ribo Life Science Co., Ltd (CN) 2010-09-29 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-20100317714-A1 COMPLEX MOLECULE INTERFERING THE EXPRESSION OF TARGET GENES AND ITS PREPARING METHODS DCLRE1B, RNASE1, AGO2 TYMP 1836/4885SLC6A11 4837/4885SLC6A1 4756/4885

“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.