SCHEMBL4677586

SCHEMBL4677586

CC(C)COC(=O)C(C)(C)[O]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.45
ALDH1A1 P00352 3/20 0.41
PRKCA P17252 1/20 0.39
MMP8 P22894 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
RAB9A P51151 1/20 0.33
P2RX4 Q99571 1/20 0.33
MAPK1 P28482 2/20 0.32
GAA P10253 1/20 0.32
NR1H3 Q13133 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
NFKB1 P19838 1/20 0.32

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
SCHEMBL4678855 0.84 TSHR (0.43) TSHRALDH1A1PRKCAMMP8SMN1; SMN2
SCHEMBL685935 0.83 PRKCA (0.55) TSHRALDH1A1PRKCAMMP8SMN1; SMN2
SCHEMBL7945587 0.83 TSHR (0.46) TSHRALDH1A1PRKCAMMP8SMN1; SMN2
SCHEMBL1785988 0.83 TSHR (0.46) TSHRALDH1A1PRKCAMMP8SMN1; SMN2
SCHEMBL4675617 0.81 TSHR (0.45) TSHRALDH1A1PRKCAMMP8SMN1; SMN2
SCHEMBL6178859 0.81 TSHR (0.45) TSHRALDH1A1PRKCAMMP8SMN1; SMN2
SCHEMBL4677590 0.81 TSHR (0.45) TSHRALDH1A1PRKCAMMP8SMN1; SMN2
SCHEMBL4675614 0.79 TSHR (0.43) TSHRALDH1A1PRKCAMMP8SMN1; SMN2
SCHEMBL19452182 0.79 TSHR (0.44) TSHRALDH1A1PRKCAMMP8SMN1; SMN2
SCHEMBL22883305 0.79 TSHR (0.43) TSHRALDH1A1PRKCAMMP8SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1095935-B1 6-Hydroxy-5,6-dihydrouracils as herbicides SUMITOMO CHEMICAL CO (JP) 2008-12-17 EP disclosed
EP-1101761-B1 Process for producing 3-phenyluracil compounds SUMITOMO CHEMICAL CO (JP) 2005-08-17 EP disclosed
US-6410484-B1 ACTIVE MATERIAL; CONTROLLING WEEDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-06-25 US disclosed
US-6339155-B1 Process for producing 3-phenyluracil compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-15 US disclosed
EP-1101761-A2 Process for producing 3-phenyluracil compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-23 EP disclosed
EP-1095935-A1 6-Hydroxy-5,6-dihydrouracils as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-02 EP disclosed