SCHEMBL8000179

SCHEMBL8000179

CCC(OC(=O)C(C)C)C(C)(C)C(O)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL2783181 0.77
SCHEMBL3809459 0.74 PRKCA (0.31)
SCHEMBL11322783 0.73 ALDH1A1 (0.33)
SCHEMBL6909410 0.69 SMN1; SMN2 (0.31) TSHR
SCHEMBL29263280 0.69 CA2 (0.43)
SCHEMBL9929488 0.68 PRKCA (0.32)
SCHEMBL15820099 0.68 MMP8 (0.33)
SCHEMBL28287898 0.68 TSHR (0.32) TSHR
SCHEMBL4837812 0.68 TRPA1 (0.33) TSHR
SCHEMBL5076488 0.68 TSHR (0.43) TSHR

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
US-6287394-B1 APPLYING ACIDIC AQUEOUS SOLUTION AND COMPRISING A COMPLEX FROM MOLYBDATE, TUNGSTATE AND VANADATE IN CONJUNCTION WITH HETERO SPECIES TO ZINC OR ITS ALLOY SURFACE; APPLYING FILM FORMING COMPATIBLE ACID TOLERANT RESIN BHP STEEL (JLA) PTY. LTD. (AU) 2001-09-11 US disclosed
EP-0730673-B1 ANTICORROSION TREATMENT OF METAL COATED STEEL HAVING COATINGS OF ALUMINIUM, ZINC OR ALLOYS THEREOF ICI AUSTRALIA OPERATIONS (AU) 2000-04-19 EP disclosed
US-5985047-A SURFACE TREATING DISPERSION COMPRISING COMPLEX HETEROPOLY ACID SALT IN AQUEOUS ACIDIC MEDIUM CONTAINING ACID TOLERANT FILM FORMING RESIN, REACTIVE NONIONIC SURFACTANT, CROSSLINKING AGENT ICI AUSTRALIA OPERATIONS PTY. LTD. (AU) 1999-11-16 US disclosed