SCHEMBL6826410

SCHEMBL6826410

CC(C)c1ccc2c(c1)cc(C(=O)N1CCN(C)CC1)n2S(=O)(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.55
KMT2A Q03164 4/20 0.43
HRH3 Q9Y5N1 1/20 0.43
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.41
GAA P10253 2/20 0.41
ALOX5 P09917 1/20 0.41
HPGD P15428 1/20 0.41
PABPC1 P11940 1/20 0.41
EIF4H Q15056 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
MEN1 O00255 2/20 0.41
LMNA P02545 2/20 0.41
PKM P14618 1/20 0.41
POLB P06746 1/20 0.40
HTR6 P50406 3/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
ACLY P53396 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL6925689 0.94 SLC2A1 (0.48) SLC2A1KMT2AHRH3ALDH1A1TSHR
SCHEMBL6829377 0.90 HRH3 (0.53) SLC2A1KMT2AHRH3ALDH1A1TSHR
SCHEMBL6924887 0.88 ALOX5 (0.52) SLC2A1KMT2AALDH1A1TSHRGAA
SCHEMBL6829119 0.87 HTR6 (0.45) SLC2A1KMT2AHRH3ALDH1A1TSHR
SCHEMBL6829881 0.86 SLC2A1 (0.56) SLC2A1ALDH1A1TSHRGAAALOX5
SCHEMBL7068535 0.84 HTR6 (0.54) SLC2A1KMT2AHRH3ALDH1A1TSHR
SCHEMBL6831430 0.83 SLC2A1 (0.55) SLC2A1KMT2AHRH3ALDH1A1TSHR
SCHEMBL6924163 0.83 SLC2A1 (0.43) SLC2A1KMT2AHRH3ALDH1A1TSHR
SCHEMBL6826365 0.82 SLC2A1 (0.57) SLC2A1KMT2AHRH3ALDH1A1GAA
SCHEMBL6826496 0.82 SLC2A1 (0.54) SLC2A1KMT2AHRH3ALDH1A1TSHR

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