SCHEMBL8025948

SCHEMBL8025948

CCc1cc2c(OS(=O)(=O)C(F)(F)F)cccc2n1C

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.42
DRD3 P35462 9/20 0.42
DRD4 P21917 7/20 0.42
DRD1 P21728 5/20 0.42
DRD5 P21918 5/20 0.42
RHEB Q15382 1/20 0.39
HTR5A P47898 1/20 0.39
HTR1D P28221 2/20 0.37
MTNR1B P49286 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
SCHEMBL8015186 0.76 RHEB (0.47) RHEBMTNR1B
SCHEMBL13604212 0.73 DRD2 (0.46) DRD2DRD3DRD4DRD1DRD5
SCHEMBL30707207 0.72 CCR4 (0.40) DRD2DRD3DRD4DRD1DRD5
SCHEMBL29706003 0.72 MEN1 (0.42) DRD2DRD3DRD4DRD1DRD5
SCHEMBL203899 0.72 MEN1 (0.42) DRD2DRD3DRD4DRD1DRD5
SCHEMBL8015473 0.70 MAPT (0.42) RHEB
SCHEMBL3927466 0.69 DRD2 (0.34) DRD2DRD3DRD4DRD1DRD5
SCHEMBL4376769 0.69 DRD2 (0.46) DRD2DRD3DRD4DRD1DRD5
SCHEMBL13678676 0.69 KDM4E (0.43) DRD2DRD3DRD4DRD1DRD5
SCHEMBL12476299 0.68 MEN1 (0.41) DRD2DRD3DRD4DRD1DRD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000061554-A1 1-AMINO ETHYLINDOLE DERIVATIVES FOR THE TREATMENT OF URINARY INCONTINENCE SANOFI-SYNTHELABO (FR) 2000-10-19 WO disclosed
WO-2000061553-A1 2-AMINOETHYL-INDOLE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE SANOFI-SYNTHELABO (FR) 2000-10-19 WO disclosed