SCHEMBL4677620

SCHEMBL4677620

CC(C)(S)C(=O)OC1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.50
EPHX1 P07099 2/20 0.44
NAAA Q02083 2/20 0.41
HTT P42858 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP2C19 P33261 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
CHRM3 P20309 5/20 0.37
CHRM2 P08172 3/20 0.36
LMNA P02545 1/20 0.36
CYP2D6 P10635 1/20 0.36
SLC6A4 P31645 1/20 0.36
KCNH2 Q12809 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
SCHEMBL4679280 0.98 CYP19A1 (0.47) CYP19A1EPHX1NAAAHTTNPC1
SCHEMBL2182130 0.83 CYP19A1 (0.53) CYP19A1EPHX1NAAAHTTNPC1
SCHEMBL28317353 0.83 CYP19A1 (0.53) CYP19A1EPHX1NAAAHTTNPC1
Ammonia Solution, Strong SCHEMBL27920558 0.81 CYP19A1 (0.51) CYP19A1EPHX1NAAAHTTNPC1
SCHEMBL4679066 0.81 CYP19A1 (0.51) CYP19A1EPHX1NAAAHTTNPC1
SCHEMBL3717139 0.81 CYP19A1 (0.51) CYP19A1EPHX1NAAAHTTNPC1
SCHEMBL1682649 0.80 CYP19A1 (0.50) CYP19A1EPHX1NAAAHTTNPC1
SCHEMBL11991229 0.80 CYP19A1 (0.47) CYP19A1EPHX1NAAAHTTNPC1
SCHEMBL23018464 0.79 CYP19A1 (0.54) CYP19A1EPHX1NAAAHTTNPC1
SCHEMBL4673661 0.79 CYP19A1 (0.50) CYP19A1EPHX1NAAAHTTNPC1

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