SCHEMBL6858115

SCHEMBL6858115

O=C1CN(Cc2ccccc2)C(=S)[N]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.44
MEN1 O00255 6/20 0.44
EPHX2 P34913 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
POLB P06746 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
F2 P00734 1/20 0.41
PLG P00747 1/20 0.41
ELANE P08246 1/20 0.41
CTSG P08311 1/20 0.41
CMA1 P23946 1/20 0.41
CTRC Q99895 1/20 0.41
DRD3 P35462 1/20 0.41
KCNH2 Q12809 1/20 0.41

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
SCHEMBL6855698 0.83 DDB1 (0.51) KMT2AMEN1L3MBTL1DDB1CRBN
SCHEMBL4892237 0.82 EPHX2 (0.45) KMT2AMEN1EPHX2L3MBTL1DDB1
SCHEMBL3451882 0.74 SIGMAR1 (0.54) KMT2AL3MBTL1POLBGSK3AGSK3B
SCHEMBL10417429 0.72 L3MBTL1 (0.48) KMT2AMEN1EPHX2L3MBTL1DDB1
SCHEMBL7745544 0.72 EPHX2 (0.46) KMT2AMEN1EPHX2L3MBTL1DDB1
SCHEMBL1488276 0.71 L3MBTL1 (0.56) KMT2AMEN1EPHX2L3MBTL1DDB1
SCHEMBL6853577 0.69 GAA (0.50) KMT2AMEN1DDB1CRBNCTSG
SCHEMBL10649531 0.69 EPHX2 (0.62) KMT2AMEN1EPHX2L3MBTL1DDB1
SCHEMBL6855500 0.69 DDB1 (0.54) KMT2AMEN1L3MBTL1DDB1CRBN
SCHEMBL7430313 0.68 EPHX2 (0.49) KMT2AMEN1EPHX2L3MBTL1DDB1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6784293-B1 SOLUTION AND SOLID-PHASE SYNTHESIS OF BOC-PROTECTED 3-AMINOHYDANTOINS/THIOHYDANTOINS AND 3-AMINODIHYDROURACILS/ DIHYDROTHIOURACILS THE PROCTER & GAMBLE COMPANY 2004-08-31 US disclosed