SCHEMBL4673181

SCHEMBL4673181

CC(C)CCCOC(=O)C[NH]

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.38
PTPN1 P18031 1/20 0.37
NAAA Q02083 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
RARB P10826 1/20 0.36
BLM P54132 1/20 0.35
EPHX2 P34913 1/20 0.35
ACHE P22303 1/20 0.35
MAPK1 P28482 1/20 0.33
CA1 P00915 2/20 0.32
DGKA P23743 1/20 0.32
CA12 O43570 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
PPIA P62937 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
SCHEMBL4673050 0.87 CYP19A1 (0.47) CYP19A1TDP1EPHX2ACHEMAPK1
SCHEMBL10654547 0.83 ADRA2A (0.46) CYP19A1PTPN1NAAATDP1RARB
SCHEMBL27809021 0.83 MGAM (0.42) CYP19A1PTPN1NAAATDP1RARB
SCHEMBL4285860 0.81 DGKA (0.47) CYP19A1PTPN1NAAATDP1RARB
SCHEMBL128491 0.81 NAAA (0.57) CYP19A1NAAATDP1RARBBLM
SCHEMBL322130 0.81 DGKA (0.52) CYP19A1TDP1BLMCA1DGKA
SCHEMBL7591037 0.81 CA1 (0.43) CYP19A1PTPN1NAAATDP1RARB
SCHEMBL18338892 0.81 MMP1 (0.39) CYP19A1NAAATDP1RARBBLM
SCHEMBL4672636 0.81 CYP19A1 (0.42) CYP19A1PTPN1NAAATDP1RARB
SCHEMBL4672632 0.81 CYP19A1 (0.39) CYP19A1PTPN1NAAATDP1RARB

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 3 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
US-6410484-B1 ACTIVE MATERIAL; CONTROLLING WEEDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-06-25 US disclosed
EP-1095935-A1 6-Hydroxy-5,6-dihydrouracils as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-02 EP disclosed