SCHEMBL6928279

SCHEMBL6928279

CCOc1ccc2c(c1)c(Br)c(CN1CCN(C)CC1)n2S(=O)(=O)c1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 18/20 0.53
CYP3A4 P08684 3/20 0.53
CYP2D6 P10635 3/20 0.53
KDM4E B2RXH2 1/20 0.44
TSHR P16473 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL6831378 0.83 HTR6 (0.56) HTR6CYP3A4CYP2D6
SCHEMBL6920527 0.73 HTR6 (0.68) HTR6CYP3A4CYP2D6POLB
SCHEMBL6829140 0.71 HRH3 (0.55) CYP3A4CYP2D6KDM4ETSHRPOLB
SCHEMBL949684 0.69 HTR6 (1.00) HTR6CYP3A4CYP2D6
SCHEMBL29646284 0.69 HTR6 (1.00) HTR6CYP3A4CYP2D6
SCHEMBL6826181 0.69 HTR6 (0.48) HTR6CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL19629781 0.69 HTR6 (0.98) HTR6CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL29646259 0.69 HTR6 (0.98) HTR6CYP3A4CYP2D6
SCHEMBL947210 0.68 HTR6 (0.74) HTR6CYP3A4CYP2D6
SCHEMBL946222 0.67 HTR6 (1.00) HTR6CYP3A4CYP2D6

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