SCHEMBL8089771

SCHEMBL8089771

O=C1CSCN1c1cccc(I)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
FAAH O00519 1/20 0.46
MGLL Q99685 1/20 0.46
KMT2A Q03164 6/20 0.44
MEN1 O00255 5/20 0.44
ALDH1A1 P00352 2/20 0.44
MPI P34949 1/20 0.41
DRD2 P14416 1/20 0.36
DRD3 P35462 1/20 0.36
KCNH2 Q12809 1/20 0.36
P2RX7 Q99572 1/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
USP2 O75604 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL8096492 0.81 MAPT (0.64) MAPTMGLLKMT2AMEN1ALDH1A1
SCHEMBL8096930 0.80 MEN1 (0.51) MAPTMGLLKMT2AMEN1ALDH1A1
SCHEMBL8096511 0.80 L3MBTL1 (0.53) MAPTMGLLKMT2AMEN1GAA
SCHEMBL8099171 0.80 MEN1 (0.51) MAPTFAAHMGLLKMT2AMEN1
SCHEMBL6031714 0.78 ALDH1A1 (0.59) MAPTKMT2AMEN1ALDH1A1GAA
SCHEMBL8099334 0.78 MGLL (0.49) MAPTMGLLMPIDRD2DRD3
SCHEMBL8098475 0.76 CTSG (0.47) MAPTFAAHMGLLKMT2AMEN1
SCHEMBL8105974 0.76 MEN1 (0.49) MAPTKMT2AMEN1ALDH1A1MPI
SCHEMBL8104981 0.76 NSD2 (0.54) MAPTDRD2DRD3KCNH2
SCHEMBL8103929 0.76 ALOX5 (0.45) MAPTKMT2AMEN1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672038-B1 HERBICIDES ZENECA LTD (GB) 2000-01-19 EP disclosed
US-5856273-A CONTROLLING WEEDS ZENECA LIMITED (GB) 1999-01-05 US disclosed
EP-0672038-A1 HERBICIDES ZENECA LIMITED (GB) 1995-09-20 EP disclosed
WO-1994013652-A1 HERBICIDES ZENECA LIMITED (GB) 1994-06-23 WO disclosed