SCHEMBL6921864

SCHEMBL6921864

Cc1ccc2c(c1)cc(C(=O)N1CCN(C)CC1)n2S(=O)(=O)c1ccc(F)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.51
NOD2 Q9HC29 2/20 0.47
NOD1 Q9Y239 2/20 0.47
SLC2A1 P11166 1/20 0.47
ALOX5 P09917 1/20 0.47
IDO1 P14902 1/20 0.45
HRH4 Q9H3N8 1/20 0.43
LMNA P02545 2/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
HTR6 P50406 3/20 0.41
GPR183 P32249 1/20 0.41
GAA P10253 1/20 0.41
PKM P14618 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
SCHEMBL6826439 0.89 LMNA (0.50) HRH3NOD2NOD1SLC2A1ALOX5
SCHEMBL6830280 0.88 IDO1 (0.47) HRH3NOD2NOD1SLC2A1ALOX5
SCHEMBL6829301 0.87 NOD2 (0.60) HRH3NOD2NOD1SLC2A1ALOX5
SCHEMBL6829377 0.87 HRH3 (0.53) HRH3NOD2NOD1SLC2A1LMNA
SCHEMBL6826373 0.87 HRH3 (0.58) HRH3NOD2NOD1SLC2A1IDO1
SCHEMBL6829439 0.86 HRH3 (0.49) HRH3NOD2NOD1SLC2A1ALOX5
SCHEMBL6829140 0.84 HRH3 (0.55) HRH3NOD2NOD1SLC2A1LMNA
SCHEMBL6831422 0.82 HTR6 (0.47) SLC2A1HRH4LMNATP53POLB
SCHEMBL6925689 0.80 SLC2A1 (0.48) HRH3SLC2A1ALOX5LMNAHTR6
SCHEMBL6830116 0.80 KDM4E (0.51) HRH3SLC2A1IDO1HRH4LMNA

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
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