SCHEMBL4023835

SCHEMBL4023835

C[C](C)c1cccc2c1ccn2S(=O)(=O)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 15/20 0.67
LMNA P02545 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
HTR1A P08908 3/20 0.56
HTR1D P28221 2/20 0.56
HTR1B P28222 2/20 0.56
HTR1F P30939 2/20 0.56
HTR7 P34969 2/20 0.56
DRD3 P35462 2/20 0.56
DRD2 P14416 2/20 0.55
HTR2A P28223 1/20 0.55
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54
TSHR P16473 1/20 0.54
HTT P42858 1/20 0.54
FABP4 P15090 1/20 0.53
PLK1 P53350 1/20 0.52
CYP3A4 P08684 1/20 0.52

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
SCHEMBL27849149 0.87 HTR6 (0.68) HTR6LMNASMN1; SMN2HTR1AHTR1D
SCHEMBL4022039 0.86 HTR6 (0.60) HTR6LMNASMN1; SMN2HTR1AHTR1D
SCHEMBL4784564 0.83 MEN1 (0.72) HTR6LMNASMN1; SMN2HTR1AHTR1D
SCHEMBL5758119 0.80 HTR6 (1.00) HTR6LMNAHTR1AHTR1DHTR1B
SCHEMBL3621599 0.80 HTR6 (0.68) HTR6LMNAHTR1AHTR1DHTR1B
SCHEMBL29956029 0.79 HTR6 (0.67) HTR6LMNAHTR1AHTR1DHTR1B
SCHEMBL15757545 0.79 HTR6 (0.67) HTR6LMNAHTR1AHTR1DHTR1B
SCHEMBL14722685 0.79 LMNA (0.56) HTR6LMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL7970560 0.79 FABP4 (0.60) HTR6LMNASMN1; SMN2FABP4
SCHEMBL30285505 0.79 FABP4 (0.60) HTR6LMNASMN1; SMN2FABP4

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
EP-2046741-A1 INDOLES AS 5-HT6 MODULATORS BIOVITRUM AB (publ) (SE) 2009-04-15 EP disclosed
WO-2008003703-A1 INDOLES AS 5-HT6 MODULATORS BIOVITRUM AB (PUBL) (SE) 2008-01-10 WO disclosed