SCHEMBL9718333

SCHEMBL9718333

CC(C)C(=O)OCC(C)(C)C(OC(=O)CCCCC(=O)OC(C(C)C)C(C)(C)COC(=O)C(C)C)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.35
MAPT P10636 3/20 0.33
MAPK1 P28482 1/20 0.33
PRKCA P17252 1/20 0.33
PRKCE Q02156 1/20 0.33
PRKCQ Q04759 1/20 0.33
PRKCD Q05655 1/20 0.33
POLB P06746 1/20 0.30
DGKA P23743 1/20 0.30

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
SCHEMBL11291925 0.94 TSHR (0.35) LMNAALDH1A1MAPTMAPK1
SCHEMBL4445941 0.89 LMNA (0.36) LMNAALDH1A1
SCHEMBL11289512 0.88 KDM6B (0.33)
SCHEMBL29796685 0.84 ALDH1A1 (0.33) ALDH1A1MAPTPOLB
SCHEMBL43993 0.84 ALDH1A1 (0.33) ALDH1A1MAPTPOLB
SCHEMBL6575865 0.83 LMNA (0.54) LMNAALDH1A1MAPTMAPK1PRKCA
SCHEMBL6536003 0.83 LMNA (0.54) LMNAALDH1A1MAPTMAPK1PRKCA
SCHEMBL11291928 0.82 TSHR (0.35) LMNAALDH1A1MAPTPRKCAPRKCE
SCHEMBL11315933 0.81 TSHR (0.35) ALDH1A1MAPTPOLB
SCHEMBL30038608 0.81 ALDH1A1 (0.32) ALDH1A1MAPTPOLB

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-0358181-A2 Polyvinyl chloride blends having improved physical properties The Geon Company (US) 1990-03-14 EP claimed
EP-0473915-A1 Improved barrier PVC resins, compounds and articles derived therefrom THE B.F. GOODRICH COMPANY (US) 1992-03-11 EP disclosed
US-4348455-A BY COATING WITH AN ALKALI METAL DIALKYL SULFOSUCCINATE MOBIL OIL CORPORATION (US) 1982-09-07 US disclosed