SCHEMBL7918530

SCHEMBL7918530

CC(C)(C)OC(=O)N1CCC[C@H]1COS(=O)(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 1/20 0.49
NR1H2 P55055 6/20 0.48
NR1H3 Q13133 5/20 0.48
OPRD1 P41143 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM1A O60341 1/20 0.44
APP P05067 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
DRD2 P14416 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
SLC6A2 P23975 1/20 0.44
HRH2 P25021 1/20 0.44
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
HTR7 P34969 1/20 0.44

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
SCHEMBL7918528 1.00 HCRTR2 (0.49) HCRTR2NR1H2NR1H3OPRD1MEN1
SCHEMBL143674 0.89 LMNA (0.47) HCRTR2OPRD1MEN1KMT2AAPP
SCHEMBL86666 0.89 LMNA (0.47) HCRTR2OPRD1MEN1KMT2AAPP
SCHEMBL345625 0.89 LMNA (0.47) HCRTR2OPRD1MEN1KMT2AAPP
SCHEMBL9850372 0.87 STS (0.51) MEN1KMT2AAPPHTR1AADRA2A
SCHEMBL7734440 0.87 MEN1 (0.46) HCRTR2NR1H2NR1H3OPRD1MEN1
SCHEMBL28433249 0.87 MEN1 (0.46) HCRTR2NR1H2NR1H3OPRD1MEN1
SCHEMBL9850364 0.87 STS (0.51) MEN1KMT2AAPPHTR1AADRA2A
SCHEMBL4809535 0.86 LMNA (0.43) HCRTR2MEN1KMT2AKDM1AAPP
SCHEMBL29407129 0.85 STS (0.51) HCRTR2NR1H2NR1H3OPRD1MEN1

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
US-6221865-B1 INHIBITORS OF PROTEIN FARNESYLTRANSFERASE AND PROTEIN GERANYLGERANYLTRANSFERASE. UNIVERSITY OF PITTSBURGH 2001-04-24 US disclosed