SCHEMBL4676907

SCHEMBL4676907

CC(C)(C)OC(=O)C(C)(C)S

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.50
ALDH1A1 P00352 3/20 0.35
MAPT P10636 1/20 0.35
PTGS1 P23219 1/20 0.35
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
APLNR P35414 1/20 0.31
USP2 O75604 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CA12 O43570 1/20 0.31
CA14 Q9ULX7 1/20 0.31
ELANE P08246 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL28374586 0.80 DGAT1 (0.48) DGAT1ALDH1A1APLNRUSP2SMN1; SMN2
SCHEMBL4615927 0.78 DGAT1 (0.46) DGAT1ALDH1A1MAPTPTGS1
SCHEMBL13107710 0.78 DGAT1 (0.46) DGAT1CA14
SCHEMBL3141601 0.75 DGAT1 (0.79) DGAT1ALDH1A1CA1CA2CA7
SCHEMBL8373655 0.75 ALDH1A1 (0.38) DGAT1ALDH1A1MAPTPTGS1
SCHEMBL307610 0.75 DGAT1 (0.55) DGAT1ALDH1A1USP2SMN1; SMN2ELANE
SCHEMBL15965830 0.74 DGAT1 (0.48) DGAT1CA1CA2CA7MEN1
SCHEMBL13206619 0.74 DGAT1 (0.48) DGAT1CA1CA2CA7MEN1
SCHEMBL12199750 0.74 DGAT1 (0.48) DGAT1CA1CA2CA7MEN1
SCHEMBL1845680 0.74 DGAT1 (0.60) DGAT1CA2CA12CA14TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010064633-A1 CARBOXYLIC ACID DERIVATIVE CONTAINING THIAZOLE RING AND PHARMACEUTICAL USE THEREOF 田辺三菱製薬株式会社 (JP) 2010-06-10 WO disclosed
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-1095022-A1 RETROVIRAL PROTEASE INHIBITORS G.D. SEARLE & CO. (US) 2001-05-02 EP disclosed
EP-1095935-A1 6-Hydroxy-5,6-dihydrouracils as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-02 EP disclosed
WO-2000002862-A1 RETROVIRAL PROTEASE INHIBITORS G.D. SEARLE & CO. (US) 2000-01-20 WO disclosed
EP-0641325-A1 RETROVIRAL PROTEASE INHIBITORS MONSANTO COMPANY (US) 1995-03-08 EP disclosed