SCHEMBL3407791

SCHEMBL3407791

CN1CCN(Cc2ccc3c(c2)c(Cl)cn3S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 17/20 1.00
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CHKA P35790 1/20 0.45

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 SCHEMBL3220803 0.99 HTR6 (0.98) HTR6MEN1ALDH1A1TSHRKMT2A
SCHEMBL3223023 0.86 HTR6 (1.00) HTR6
SCHEMBL3411879 0.82 HTR6 (1.00) HTR6
Hydrochloric Acid SCHEMBL3224117 0.81 HTR6 (0.98) HTR6
SCHEMBL3204910 0.80 HTR6 (1.00) HTR6
SCHEMBL3206467 0.80 HTR6 (1.00) HTR6
Fluorobenzene SCHEMBL27780258 0.71 HTR6 (0.66) HTR6
SCHEMBL2056183 0.71 CHKA (0.80) ALDH1A1L3MBTL1CHKA
Chlorobenzene SCHEMBL27758929 0.70 HTR6 (0.65) HTR6
Hydrochloric Acid SCHEMBL27780343 0.70 HTR6 (0.62) HTR6

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