SCHEMBL4676948

SCHEMBL4676948

CC([S])C(=O)OC1CCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.44
EPHX1 P07099 2/20 0.37
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
NAAA Q02083 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
HTT P42858 2/20 0.33
CYP2D6 P10635 2/20 0.33
LMNA P02545 2/20 0.33
CHRM2 P08172 2/20 0.33
CHRM4 P08173 2/20 0.33
CHRM5 P08912 2/20 0.33
THRB P10828 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
BLM P54132 2/20 0.33
PMP22 Q01453 2/20 0.33
MEN1 O00255 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
SCHEMBL4676642 0.96 CYP19A1 (0.47) CYP19A1EPHX1CA12CA1CA2
SCHEMBL4678219 0.94 CYP19A1 (0.50) CYP19A1EPHX1CA12CA1CA2
SCHEMBL4676266 0.91
SCHEMBL7915891 0.82 CYP19A1 (0.46) CYP19A1EPHX1CA12CA1CA2
SCHEMBL4676656 0.80 CYP19A1 (0.45) CYP19A1EPHX1CA12CA1CA2
SCHEMBL6580123 0.80 CYP19A1 (0.45) CYP19A1EPHX1NAAAL3MBTL1HTT
SCHEMBL25401207 0.78 CYP19A1 (0.44) CYP19A1EPHX1CA12CA1CA2
SCHEMBL18378683 0.78 CYP19A1 (0.44) CYP19A1EPHX1NAAAL3MBTL1HTT
SCHEMBL4672747 0.78 CYP19A1 (0.44) CYP19A1EPHX1NAAAL3MBTL1HTT
SCHEMBL15574877 0.78 CYP19A1 (0.44) CYP19A1EPHX1NAAAL3MBTL1HTT

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