SCHEMBL9576752

SCHEMBL9576752

C=CC(=O)OC(C)(C)N(CC)CC

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.38
HPGD P15428 1/20 0.38
THRB P10828 3/20 0.36
ALDH1A1 P00352 5/20 0.34
TP53 P04637 3/20 0.34
HIF1A Q16665 3/20 0.34
CYP3A4 P08684 2/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 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
SCHEMBL1683533 0.88 HPGD (0.32) TSHRHPGDTHRB
SCHEMBL16295041 0.84 ALDH1A1 (0.38) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL4369134 0.84 TSHR (0.38) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL9576620 0.77 TSHR (0.36) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL11424254 0.77 THRB (0.38) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL9576599 0.77 TSHR (0.34) TSHRHPGDTHRBALDH1A1TP53
Chloromethane SCHEMBL27908729 0.75 TSHR (0.33) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL6557503 0.74 TSHR (0.35) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL23493897 0.73 THRB (0.44) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL15268464 0.73 ALDH1A1 (0.48) TSHRHPGDTHRBALDH1A1TP53

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-5273789-A UV radiation of a blend of propylene, an ethylene-propylene rubber and an ethylene-(meth)acrylic acid copolymer followed by painting SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-12-28 US claimed
CN-103502363-A Dye dispersion, photosensitive resin composition for color filter, color filter, liquid crystal display device, and organic light-emitting display device DAINIPPON PRINTING CO LTD 2014-01-08 CN disclosed
US-5273789-A UV radiation of a blend of propylene, an ethylene-propylene rubber and an ethylene-(meth)acrylic acid copolymer followed by painting SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-12-28 US disclosed
EP-0527633-A1 Method of treating surface of molded article of polypropylene resin and method of coating said molded article SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1993-02-17 EP disclosed