SCHEMBL23714864

SCHEMBL23714864

O=C=C1CCCC12CCc1ccc(OS(=O)(=O)C(F)(F)F)cc12

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.36
DRD3 P35462 6/20 0.36
HTR1D P28221 2/20 0.36
STS P08842 1/20 0.36
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CHRM1 P11229 4/20 0.31
DRD4 P21917 3/20 0.31
HTR2C P28335 1/20 0.31
HTR7 P34969 1/20 0.31
HTR6 P50406 1/20 0.31
HTR1A P08908 1/20 0.31
HTR1B P28222 1/20 0.31
BACE1 P56817 1/20 0.30
HSD11B1 P28845 1/20 0.30

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
SCHEMBL25186921 0.84 DRD2 (0.38) DRD2DRD3HTR1DSTSCA1
SCHEMBL1129301 0.70 DRD2 (0.34) DRD2DRD3HTR1DSTSCHRM1
SCHEMBL10158670 0.70 STS (0.42) DRD2DRD3HTR1DSTSCA1
SCHEMBL5026108 0.70 STS (0.64) DRD2DRD3HTR1DSTSCA1
SCHEMBL4427945 0.70 STS (0.59) DRD2DRD3HTR1DSTSCA1
SCHEMBL21468547 0.69 STS (0.62) DRD2DRD3HTR1DSTSCA1
SCHEMBL19460607 0.69 STS (0.40) DRD2DRD3HTR1DSTSCA1
SCHEMBL30935381 0.68 STS (0.39) DRD2DRD3HTR1DSTSCA1
SCHEMBL30831471 0.68 DRD2 (0.42) DRD2DRD3HTR1DHSD11B1
SCHEMBL1933990 0.67 DRD2 (0.41) DRD2DRD3HTR1DSTSCA2

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
WO-2021155316-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed