SCHEMBL8460951

SCHEMBL8460951

CCC(C(=O)C(C)(C)CC)C(=O)C(C)(C)CC

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
RIPK1 Q13546 3/20 0.31
CA2 P00918 1/20 0.30
MAPK1 P28482 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
SCHEMBL17433678 0.90 CA2 (0.37) RIPK1CA2MAPK1
SCHEMBL15656492 0.86
SCHEMBL8461977 0.78 RNPEP (0.33)
SCHEMBL8460018 0.78 TSHR (0.35) TSHRCA2MAPK1
SCHEMBL12060203 0.77 TSHR (0.31) TSHRRIPK1
SCHEMBL474110 0.77 ENPEP (0.35) RIPK1
SCHEMBL14341529 0.76 TSHR (0.33) TSHRRIPK1
SCHEMBL10044964 0.76 CYP1A2 (0.38) RIPK1
SCHEMBL8463336 0.76 RIPK1 (0.32) TSHRRIPK1CA2
SCHEMBL8458770 0.75 ALDH1A1 (0.30) 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
EP-0646605-B1 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC (US) 1999-06-02 EP disclosed
US-5468704-A Comprising titanium halide or halogen alcoholate supported on magnesium halide and a diketone electron donor; preparing polypropylene of high isotacticity MONTELL NORTH AMERICA INC. (US) 1995-11-21 US disclosed
EP-0646605-A1 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC. (US) 1995-04-05 EP disclosed