SCHEMBL14617867

SCHEMBL14617867

COc1ccc(C2(O)O[C@H](COCc3ccccc3)[C@@H](C)[C@H](C)[C@H]2OCc2ccccc2)cc1Cc1ccc2c(c1)CCC1(CCC1)O2

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.33
SLC5A1 P13866 2/20 0.32
SLC5A2 P31639 2/20 0.32
OPRM1 P35372 1/20 0.32
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 1/20 0.30
EDNRB P24530 1/20 0.30
EDNRA P25101 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
SCHEMBL14617863 0.85
SCHEMBL15030922 0.80
SCHEMBL10328198 0.80
SCHEMBL15030917 0.80 SLC5A2 (0.41) PDE10ASLC5A1SLC5A2OPRM1
SCHEMBL10328070 0.80 SLC5A2 (0.41) PDE10ASLC5A1SLC5A2OPRM1
SCHEMBL1672778 0.80 PTPN1 (0.33) OPRM1
SCHEMBL14644433 0.79 PDE10A (0.33) PDE10ASLC5A1SLC5A2OPRM1
SCHEMBL16727616 0.78 DRD2 (0.30)
SCHEMBL2087974 0.78 SLC5A2 (0.41) PDE10ASLC5A1SLC5A2OPRM1
SCHEMBL18511210 0.77

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-8828951-B2 Glycoside derivatives and uses thereof NOVARTIS AG (CH) 2014-09-09 US disclosed
US-20130017993-A1 GLYCOSIDE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2013-01-17 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-20130017993-A1 GLYCOSIDE DERIVATIVES AND USES THEREOF SLC5A1, SLC5A2, SLC2A1 PDE10A 863/4885SLC5A1 1/4885SLC5A2 2/4885

“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.