SCHEMBL22648808

SCHEMBL22648808

C=CC(=O)OCCNC(=O)OCCOc1ccc2c(c1)-c1cc(OCCOC(=O)NCCOC(C)=O)ccc1C21c2ccccc2-c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.44
PDK2 Q15119 13/20 0.42
MAPT P10636 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
P2RY12 Q9H244 1/20 0.33

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
SCHEMBL22648010 0.95 THRB (0.48) THRBPDK2MAPTL3MBTL1LMNA
SCHEMBL22648011 0.85 PDK2 (0.45) PDK2MAPTL3MBTL1LMNATP53
SCHEMBL13714848 0.84 THRB (0.52) THRBPDK2MAPTL3MBTL1LMNA
SCHEMBL30466297 0.84 THRB (0.52) THRBPDK2MAPTL3MBTL1LMNA
SCHEMBL20411188 0.83 THRB (0.53) THRBPDK2MAPTL3MBTL1LMNA
SCHEMBL25784675 0.82 THRB (0.47) THRBPDK2MAPTL3MBTL1LMNA
SCHEMBL31633683 0.79 THRB (0.54) THRBPDK2
SCHEMBL24268381 0.77 THRB (0.53) THRBPDK2MAPTLMNATP53
SCHEMBL16903531 0.74 THRB (0.46) THRBPDK2MAPTLMNA
SCHEMBL40434 0.74 THRB (0.63) THRBPDK2MAPTLMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200354311-A1 FLUORENE DERIVATIZED MONOMERS AND POLYMERS FOR VOLUME BRAGG GRATINGS META PLATFORMS TECHNOLOGIES, LLC 2020-11-12 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-20200354311-A1 FLUORENE DERIVATIZED MONOMERS AND POLYMERS FOR VOLUME BRAGG GRATINGS RHOA, PARG, LSG1 THRB 4265/4885PDK2 4171/4885MAPT 2962/4885

“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.