SCHEMBL3409339

SCHEMBL3409339

CCN1CCN(Cc2ccc3c(c2)c(Br)cn3S(=O)(=O)c2ccc(Cl)cc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 19/20 0.68
TP53 P04637 1/20 0.51
MAPT P10636 1/20 0.51
CHRM1 P11229 1/20 0.48

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
Hydrochloric Acid SCHEMBL3211050 0.99 HTR6 (0.67) HTR6TP53MAPTCHRM1
SCHEMBL3206467 0.81 HTR6 (1.00) HTR6
SCHEMBL3411022 0.80 HTR6 (1.00) HTR6CHRM1
Hydrochloric Acid SCHEMBL3219449 0.79 HTR6 (0.98) HTR6CHRM1
Hydrochloric Acid SCHEMBL1354820 0.75 HTR6 (0.64) HTR6
SCHEMBL13257976 0.74 L3MBTL1 (0.51) HTR6
SCHEMBL13257975 0.74 KDM4E (0.51) HTR6
SCHEMBL3413817 0.73 HTR6 (0.82) HTR6CHRM1
SCHEMBL3204910 0.73 HTR6 (1.00) HTR6
Hydrochloric Acid SCHEMBL3216811 0.72 HTR6 (0.80) HTR6CHRM1

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
EP-2114878-B1 5-(HETEROCYCLYL)ALKYL-N-(ARYLSULFONYL)INDOLE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS SUVEN LIFE SCIENCES LTD (IN) 2010-12-15 EP claimed