SCHEMBL4679280

SCHEMBL4679280

CC(C)(S)C(=O)OC1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.47
EPHX1 P07099 2/20 0.41
NAAA Q02083 2/20 0.39
CHRM3 P20309 9/20 0.38
HTT P42858 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CHRM2 P08172 6/20 0.36
LMNA P02545 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
SLC6A4 P31645 1/20 0.36
KCNH2 Q12809 1/20 0.36
SLC22A1 O15245 1/20 0.36

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
SCHEMBL4677620 0.98 CYP19A1 (0.50) CYP19A1EPHX1NAAACHRM3HTT
SCHEMBL1682649 0.82 CYP19A1 (0.50) CYP19A1EPHX1NAAACHRM3HTT
SCHEMBL2182130 0.80 CYP19A1 (0.53) CYP19A1EPHX1NAAACHRM3HTT
SCHEMBL28317353 0.80 CYP19A1 (0.53) CYP19A1EPHX1NAAACHRM3HTT
SCHEMBL4673117 0.80 CYP19A1 (0.49) CYP19A1EPHX1NAAACHRM3HTT
SCHEMBL4679178 0.80 CYP19A1 (0.49) CYP19A1EPHX1NAAACHRM3HTT
SCHEMBL685904 0.78 CYP19A1 (0.47) CYP19A1EPHX1NAAACHRM3HTT
SCHEMBL3717139 0.78 CYP19A1 (0.51) CYP19A1EPHX1NAAACHRM3HTT
SCHEMBL4679066 0.78 CYP19A1 (0.51) CYP19A1EPHX1NAAACHRM3HTT
SCHEMBL3345151 0.78 CYP19A1 (0.47) CYP19A1EPHX1NAAACHRM3HTT

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