SCHEMBL9868838

SCHEMBL9868838

CCN1CCCC1CNC(=O)c1cc(S(=O)(=O)CC)c(C)c2c1OCCC2

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.56
ADRA2B P18089 2/20 0.56
ADRA2C P18825 2/20 0.56
DRD3 P35462 2/20 0.56
HTR2B P41595 2/20 0.56
KCNH2 Q12809 2/20 0.56
HRH3 Q9Y5N1 2/20 0.56
LMNA P02545 1/20 0.56
ADRA2A P08913 1/20 0.56
ALOX15 P16050 1/20 0.56
TSHR P16473 1/20 0.56
HTR2A P28223 1/20 0.56
MAPK1 P28482 1/20 0.56
HTR7 P34969 1/20 0.56
HRH1 P35367 1/20 0.56
SLC6A4 P31645 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL9868584 0.93 DRD2 (0.49) DRD2ADRA2BADRA2CDRD3HTR2B
SCHEMBL9866760 0.84 DRD2 (0.52) DRD2ADRA2BADRA2CDRD3HTR2B
SCHEMBL11366374 0.79 DRD2 (0.60) DRD2ADRA2BADRA2CDRD3HTR2B
Hydrochloric Acid SCHEMBL11258188 0.78 DRD2 (0.59) DRD2ADRA2BADRA2CDRD3HTR2B
SCHEMBL11265100 0.77 DRD2 (0.61) DRD2ADRA2BADRA2CDRD3HTR2B
SCHEMBL10810631 0.77 CA2 (0.60) DRD2DRD3LMNAADRA2ATSHR
SCHEMBL9868987 0.77 DRD2 (0.51) DRD2ADRA2BADRA2CDRD3HTR2B
Hydrochloric Acid SCHEMBL11259196 0.77 DRD2 (0.60) DRD2ADRA2BADRA2CDRD3HTR2B
SCHEMBL9869736 0.76 DRD2 (0.45) DRD2ADRA2BADRA2CDRD3HTR2B
SCHEMBL10424729 0.76 DRD2 (0.59) DRD2

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
CN-1062144-A The preparation method of benzodihydropyran carboxamide derivatives DELAGRANGE LAB (FR) 1992-06-24 CN disclosed
US-5006570-A Dihydrobenzofuran- and chroman-carboxamide derivatives, processes for the preparation thereof and use thereof as neuroleptics LABORATOIRES DELAGRANGE (FR) 1991-04-09 US disclosed
CN-87100978-A Dihydrobenzofuran-and chroman-carboxamide derivatives, processes for their preparation and their use as neuroleptics 1987-09-16 CN disclosed