SCHEMBL9073350

SCHEMBL9073350

C=C(C)C(=O)OCCC[Si]1(C)CCCCO1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
POLB P06746 1/20 0.37
APEX1 P27695 1/20 0.37
HTT P42858 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
THRB P10828 1/20 0.37
ALDH1A1 P00352 1/20 0.36
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL5014894 0.83 TSHR (0.46) TSHRPOLBAPEX1HTTTDP1
SCHEMBL7533258 0.81 TSHR (0.49) TSHRTHRBALDH1A1
SCHEMBL5028821 0.78 TSHR (0.41) TSHRPOLBAPEX1HTTTDP1
SCHEMBL5024468 0.78 TSHR (0.42) TSHRPOLBAPEX1HTTTDP1
SCHEMBL27691277 0.78 TSHR (0.49) TSHRPOLBAPEX1HTTTDP1
SCHEMBL14559770 0.78 TSHR (0.34) TSHR
SCHEMBL27389968 0.77 TSHR (0.49) TSHRPOLBAPEX1HTTTDP1
SCHEMBL12349771 0.73 TSHR (0.44) TSHRPOLBAPEX1HTTTDP1
SCHEMBL15682455 0.73 TSHR (0.54) TSHRPOLBAPEX1HTTTDP1
SCHEMBL17460853 0.73 TSHR (0.54) TSHRPOLBAPEX1HTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5532302-A Flame retardant composition and method for use in synthetic thermoplastic resins SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-07-02 US disclosed
US-5306558-A Double-layered rubber laminate SHIN-ETSU CHEMICAL CO., LTD. (JP) 1994-04-26 US disclosed
US-4987180-A SOFTNESS, ELASTIC RESILIENCE, WINDPROOFING, WASHFASTNESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 1991-01-22 US disclosed
US-4985155-A Graft Polymer of an Acrylate on a Polysiloxane NISSIN CHEMICAL INDUSTRY CO., LTD. (JP) 1991-01-15 US disclosed