SCHEMBL4677565

SCHEMBL4677565

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

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.36
PTPN1 P18031 1/20 0.34
CA1 P00915 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
RARB P10826 1/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
HRH3 Q9Y5N1 2/20 0.33
ACHE P22303 1/20 0.33
ALDH1A1 P00352 3/20 0.32
LMNA P02545 1/20 0.32
CYP19A1 P11511 1/20 0.32
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL4672700 0.86 CA1 (0.45) CA1TDP1CA12CA2CA9
SCHEMBL8857039 0.84 BLM (0.40) BLMPTPN1CA1TDP1RARB
SCHEMBL4675873 0.82 BLM (0.39) BLMPTPN1CA1TDP1RARB
SCHEMBL4677250 0.80 ALDH1A1 (0.54) TDP1ACHEALDH1A1LMNA
SCHEMBL222546 0.80 BLM (0.38) BLMPTPN1CA1TDP1RARB
SCHEMBL1603012 0.80 BLM (0.42) BLMPTPN1CA1TDP1RARB
SCHEMBL4673372 0.80 BLM (0.38) BLMPTPN1CA1TDP1RARB
SCHEMBL9069149 0.79 BLM (0.40) BLMPTPN1CA1TDP1RARB
SCHEMBL4677570 0.78 CHRNB2 (0.38) BLMPTPN1CA1TDP1RARB
SCHEMBL4672718 0.78 BLM (0.36) BLMPTPN1CA1TDP1RARB

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