SCHEMBL8103929

SCHEMBL8103929

CSc1cccc(N2CSCC2=O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.45
MAPT P10636 4/20 0.43
ALOX15 P16050 2/20 0.41
HPGD P15428 2/20 0.41
TSHR P16473 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.39
ALDH1A1 P00352 4/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
USP2 O75604 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
ALOX12 P18054 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
HSD11B1 P28845 1/20 0.36
BACE1 P56817 2/20 0.36
FFAR4 Q5NUL3 1/20 0.35

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
SCHEMBL8096511 0.80 L3MBTL1 (0.53) ALOX5MAPTMEN1KMT2AGAA
SCHEMBL8096492 0.78 MAPT (0.64) ALOX5MAPTALDH1A1MEN1KMT2A
SCHEMBL8099334 0.77 MGLL (0.49) ALOX5MAPT
SCHEMBL8096930 0.76 MEN1 (0.51) ALOX5MAPTALDH1A1MEN1KMT2A
SCHEMBL8099171 0.76 MEN1 (0.51) ALOX5MAPTALDH1A1MEN1KMT2A
SCHEMBL11818354 0.76 ALOX5 (0.51) ALOX5MAPTALOX15HPGDTSHR
SCHEMBL8089771 0.76 MAPT (0.46) MAPTHPGDALDH1A1MEN1KMT2A
SCHEMBL8099398 0.75 ALOX5 (0.42) ALOX5MAPTALOX15HPGDTSHR
SCHEMBL8089839 0.75 DRD2 (0.44) MAPTALDH1A1MEN1KMT2AHSD11B1
SCHEMBL6031714 0.75 ALDH1A1 (0.59) MAPTALOX15HPGDTSHRALDH1A1

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