SCHEMBL22700167

SCHEMBL22700167

COc1ccc(COC[C@H]2OC(=O)[C@](C)(COC(=O)c3ccccc3)C2O[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.35
PRKCA P17252 4/20 0.34
RASGRP3 Q8IV61 4/20 0.34
NT5E P21589 1/20 0.34
PRKCE Q02156 1/20 0.34
THRB P10828 1/20 0.33
DHODH Q02127 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
SCHEMBL19974571 0.84 HDAC4 (0.33) THRB
SCHEMBL19978918 0.84 HDAC4 (0.33) THRB
SCHEMBL19974567 0.83 TBXAS1 (0.37) TBXAS1NT5EDHODH
SCHEMBL19974597 0.81 NT5E (0.36) TBXAS1NT5EDHODH
SCHEMBL26558064 0.80 GLA (0.34) THRB
SCHEMBL22700173 0.80 GLA (0.35) THRB
SCHEMBL19974581 0.77 GLA (0.33) THRB
SCHEMBL19979038 0.77 GLA (0.33) THRB
SCHEMBL19978973 0.76 GLA (0.32) THRB
SCHEMBL19974420 0.76 GLA (0.32) THRB

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
EP-3512860-B1 NUCLEOSIDE AND NUCLEOTIDE ANALOGUES BEARING A QUATERNARY ALL-CARBON STEREOGENIC CENTER AT THE 2' POSITION AND METHODS OF USE AS A CARDIOPROTECTIVE AGENT LCB PHARMA INC (CA) 2020-11-25 EP disclosed