SCHEMBL8895342

SCHEMBL8895342

CCOC(=O)C(C)(O)c1ccc(O[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
ABCB11 O95342 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HTR2A P28223 1/20 0.41
PMP22 Q01453 1/20 0.41
PPARA Q07869 1/20 0.41
PREP P48147 4/20 0.41
DRD2 P14416 1/20 0.37
PIN1 Q13526 1/20 0.37
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA9 Q16790 2/20 0.37
OPRK1 P41145 1/20 0.36
ALDH1A1 P00352 1/20 0.36
FBP1 P09467 2/20 0.36
MLYCD O95822 1/20 0.35

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
SCHEMBL8893058 0.81 PPARA (0.38) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL8892401 0.80 PREP (0.43) CYP1A2CYP3A4PPARAPREPCA12
SCHEMBL23291809 0.79 ALDH1A1 (0.48) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL9214790 0.78 TSHR (0.36) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL9290105 0.78 CNR2 (0.45) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL7308998 0.78 CA12 (0.53) TSHRCYP1A2CYP3A4CA12CA1
SCHEMBL8893037 0.77 ESR1 (0.50) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL11839741 0.77 ALDH1A1 (0.49) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL14653829 0.77 POLB (0.52) TSHRABCB11CYP1A2CYP3A4HTR2A
SCHEMBL7756224 0.77 NPC1 (0.52) TSHRABCB11CYP1A2CYP3A4HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997038997-A1 SUBSTITUTED OXAZOLIDINEDIONES AND THEIR USE AS FUNGICIDES ZENECA LIMITED (GB) 1997-10-23 WO disclosed
WO-1997038995-A1 FUNGICIDAL OXAZOLIDINEDIONE DERIVATIVES ZENECA LIMITED (GB) 1997-10-23 WO disclosed
EP-0630370-A1 FUNGICIDAL OXAZOLIDINONES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-12-28 EP disclosed
WO-1993022299-A1 FUNGICIDAL OXAZOLIDINONES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-11-11 WO disclosed
WO-1993018016-A1 FUNGICIDAL OXAZOLIDINONES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-09-16 WO disclosed