SCHEMBL4960952

SCHEMBL4960952

COc1ccccc1-c1cccc2c1OC(COS(=O)(=O)c1ccc(C)cc1)CO2

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
ADRA1D P25100 8/20 0.40
ADRA1A P35348 8/20 0.40
ADRA1B P35368 8/20 0.40
GAA P10253 1/20 0.39
HTR1A P08908 3/20 0.39
SLC6A4 P31645 1/20 0.39
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL4960706 0.92 ADRA1D (0.43) LMNASMN1; SMN2ADRA1DADRA1AADRA1B
SCHEMBL6746124 0.91 ADRA1D (0.47) LMNASMN1; SMN2ADRA1DADRA1AADRA1B
SCHEMBL6221416 0.91 ADRA1D (0.47) LMNASMN1; SMN2ADRA1DADRA1AADRA1B
SCHEMBL3894671 0.91 ADRA1D (0.47) LMNASMN1; SMN2ADRA1DADRA1AADRA1B
SCHEMBL4961338 0.90 LMNA (0.47) LMNASMN1; SMN2MAPTTSHR
SCHEMBL4961713 0.89 HTT (0.38) LMNASMN1; SMN2ADRA1DADRA1AADRA1B
SCHEMBL4962556 0.88 LMNA (0.38) LMNASMN1; SMN2ADRA1DADRA1AADRA1B
SCHEMBL4962952 0.87 LMNA (0.44) LMNASMN1; SMN2ADRA1DADRA1AADRA1B
SCHEMBL4961334 0.87 LMNA (0.44) LMNASMN1; SMN2ADRA1DADRA1AADRA1B
SCHEMBL4960403 0.87 LMNA (0.44) LMNASMN1; SMN2ADRA1DADRA1AADRA1B

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
EP-1871759-A1 BENZODIOXANE AND BENZODIOXOLANE DERIVATIVES AND USES THEREOF Wyeth a Corporation of the State of Delaware (US) 2008-01-02 EP disclosed
WO-2006116158-A1 BENZODIOXANE AND BENZODIOXOLANE DERIVATIVES AND USES THEREOF WYETH (US) 2006-11-02 WO disclosed
US-20060241172-A1 Benzodioxane and benzodioxolane derivatives and uses thereof WYETH (US) 2006-10-26 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-20060241172-A1 Benzodioxane and benzodioxolane derivatives and uses thereof HTR2C, HTR1D, HTR1A LMNA 2921/4885SMN1; SMN2 1352/4885ADRA1D 21/4885

“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.