SCHEMBL3409331

SCHEMBL3409331

CCN1CCN(Cc2ccc3c(ccn3S(=O)(=O)c3ccc(F)cc3F)c2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 19/20 1.00
CHRM1 P11229 1/20 0.67
KDM2B Q8NHM5 1/20 0.49

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 SCHEMBL3209707 0.99 HTR6 (0.98) HTR6CHRM1KDM2B
SCHEMBL3221074 0.92 HTR6 (0.85) HTR6CHRM1
SCHEMBL3408800 0.86 HTR6 (1.00) HTR6CHRM1
Hydrochloric Acid SCHEMBL3212095 0.85 HTR6 (0.98) HTR6CHRM1
SCHEMBL4313558 0.80 HTR6 (0.67) HTR6CHRM1
SCHEMBL3409661 0.80 HTR6 (1.00) HTR6CHRM1
SCHEMBL3411710 0.79 HTR6 (0.83) HTR6CHRM1
Hydrochloric Acid SCHEMBL3219058 0.79 HTR6 (0.98) HTR6CHRM1
SCHEMBL3409674 0.78 HTR6 (1.00) HTR6CHRM1
Hydrochloric Acid SCHEMBL3209863 0.78 HTR6 (0.81) 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