SCHEMBL8104930

SCHEMBL8104930

CS(=O)(=O)c1cccc(N2CSC(Cl)C2=O)c1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.45
DRD2 P14416 3/20 0.43
OPRM1 P35372 1/20 0.41
OPRL1 P41146 1/20 0.41
HSD11B1 P28845 3/20 0.40
NR1H2 P55055 9/20 0.40
NR1H3 Q13133 6/20 0.40
PTGS1 P23219 2/20 0.38
PTGS2 P35354 2/20 0.38
GPR119 Q8TDV5 1/20 0.37

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
SCHEMBL8098979 0.85 GRM2 (0.44) GRM2DRD2OPRM1OPRL1HSD11B1
SCHEMBL8098982 0.83 ALDH1A1 (0.37) GRM2NR1H2NR1H3
SCHEMBL8097791 0.81 L3MBTL1 (0.45) GRM2DRD2HSD11B1
SCHEMBL8105245 0.81 ALDH1A1 (0.47) DRD2
SCHEMBL8097196 0.79 MGLL (0.45) GRM2DRD2
SCHEMBL8096938 0.78 FADS1 (0.44) GRM2DRD2
SCHEMBL8090453 0.78 ATM (0.48) HSD11B1
SCHEMBL8089618 0.78 FAAH (0.42) DRD2HSD11B1
SCHEMBL8099398 0.78 ALOX5 (0.42) HSD11B1
SCHEMBL8089839 0.77 DRD2 (0.44) GRM2DRD2OPRM1OPRL1HSD11B1

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