SCHEMBL9199607

SCHEMBL9199607

CS(=O)(=O)c1cccc(N2CCSC2=O)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.50
GRM2 Q14416 1/20 0.44
OPRM1 P35372 1/20 0.42
OPRL1 P41146 1/20 0.42
SIGMAR1 Q99720 1/20 0.39
MLYCD O95822 1/20 0.39
HSD11B1 P28845 2/20 0.39
NR1H2 P55055 6/20 0.39
NR1H3 Q13133 5/20 0.39
GPR119 Q8TDV5 1/20 0.39
DRD3 P35462 1/20 0.37
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
KCNH2 Q12809 1/20 0.36

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
SCHEMBL13800990 0.75 ALDH1A1 (0.56) DRD2
SCHEMBL8089839 0.73 DRD2 (0.44) DRD2GRM2OPRM1OPRL1MLYCD
SCHEMBL6360683 0.73 MEN1 (0.54) SIGMAR1
SCHEMBL9207312 0.72 CNR1 (0.33)
SCHEMBL8104930 0.71 GRM2 (0.45) DRD2GRM2OPRM1OPRL1HSD11B1
SCHEMBL13800992 0.71 DRD2 (0.66) DRD2MLYCDNR1H2NR1H3GPR119
SCHEMBL17893525 0.71 DRD2 (0.61) DRD2GRM2MLYCDNR1H2NR1H3
SCHEMBL8098979 0.70 GRM2 (0.44) DRD2GRM2OPRM1OPRL1MLYCD
SCHEMBL8779983 0.70 DRD2 (0.64) DRD2MLYCDNR1H2NR1H3GPR119
SCHEMBL21442594 0.69 DRD2 (0.71) DRD2MLYCDNR1H2NR1H3GPR119

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
EP-0672038-A1 HERBICIDES ZENECA LIMITED (GB) 1995-09-20 EP disclosed