SCHEMBL6831422

SCHEMBL6831422

Cc1ccc2c(c1)cc(C(=O)N1CCN(C)CC1)n2S(=O)(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.47
GAA P10253 3/20 0.46
SLC2A1 P11166 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 2/20 0.43
TP53 P04637 1/20 0.43
CNR1 P21554 1/20 0.43
ATM Q13315 1/20 0.43
GRM5 P41594 1/20 0.42
ABL1 P00519 1/20 0.42
BCR P11274 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
HRH4 Q9H3N8 1/20 0.41

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
SCHEMBL6829119 0.88 HTR6 (0.45) HTR6GAASLC2A1LMNATP53
SCHEMBL6826779 0.87 HTR6 (0.44) HTR6GAASLC2A1LMNATP53
SCHEMBL6921864 0.82 HRH3 (0.51) HTR6GAASLC2A1LMNATP53
SCHEMBL6826439 0.80 LMNA (0.50) SLC2A1LMNAPOLBHRH4
SCHEMBL6830280 0.79 IDO1 (0.47) HTR6SLC2A1L3MBTL1LMNATP53
SCHEMBL6826453 0.77 PPARG (0.50) HTR6GAASLC2A1LMNASMN1; SMN2
SCHEMBL6829881 0.75 SLC2A1 (0.56) HTR6GAASLC2A1LMNAPOLB
SCHEMBL10259849 0.74 GAA (0.59) GAASLC2A1LMNASMN1; SMN2POLB
SCHEMBL6826410 0.73 SLC2A1 (0.55) HTR6GAASLC2A1LMNAPOLB
SCHEMBL6831430 0.73 SLC2A1 (0.55) HTR6SLC2A1L3MBTL1SMN1; SMN2POLB

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-2004108671-A1 SUBSTITUTED INDOLES WITH SEROTONIN RECEPTOR AFFINITY, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SUVEN LIFE SCIENCES LIMITED (IN) 2004-12-16 WO claimed
WO-2004108671-A1 SUBSTITUTED INDOLES WITH SEROTONIN RECEPTOR AFFINITY, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SUVEN LIFE SCIENCES LIMITED (IN) 2004-12-16 WO disclosed