SCHEMBL21167284

SCHEMBL21167284

CC(=O)OC1(C)CC2CC(C)(OC(C)=O)CC(OC(C)=O)(C2)C1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.33
EP300 Q09472 1/20 0.31
HIF1A Q16665 1/20 0.31
CREBBP Q92793 1/20 0.31
ALOX15 P16050 1/20 0.31
DPP4 P27487 1/20 0.31

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
SCHEMBL5607557 0.86 EP300 (0.35) EP300HIF1ACREBBPALOX15DPP4
SCHEMBL5608473 0.81 MEN1 (0.41)
SCHEMBL5608378 0.81 MEN1 (0.38)
SCHEMBL5607527 0.77 EP300 (0.31) EP300HIF1ACREBBPDPP4
SCHEMBL5607868 0.77 DPP4 (0.33) EP300HIF1ACREBBPDPP4
SCHEMBL75210 0.74 ALDH1A1 (0.34) EP300HIF1ACREBBPDPP4
SCHEMBL18457339 0.74 CYP17A1 (0.34) EP300HIF1ACREBBPDPP4
SCHEMBL5607904 0.74 ALDH1A1 (0.36) EP300HIF1ACREBBPDPP4
SCHEMBL5608060 0.74 MEN1 (0.33)
SCHEMBL5608309 0.74 DPP4 (0.43) DPP4

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-2623087-B1 Dental composite materials containing tricyclic plasticisers VOCO GMBH (DE) 2019-07-17 EP disclosed