SCHEMBL8273307

SCHEMBL8273307

CCN(c1ccc(Cl)cc1Cc1c(F)cccc1F)S(=O)(=O)c1ccc(OC)c(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 11/20 0.51
HCRTR1 O43613 7/20 0.51
PKM P14618 2/20 0.49
POLB P06746 1/20 0.43
MCOLN3 Q8TDD5 1/20 0.43
PSEN1 P49768 2/20 0.43
PSEN2 P49810 2/20 0.43
APH1B Q8WW43 2/20 0.43
NCSTN Q92542 2/20 0.43
APH1A Q96BI3 2/20 0.43
PSENEN Q9NZ42 2/20 0.43
MAPT P10636 2/20 0.41
ALDH1A1 P00352 2/20 0.41
TP53 P04637 1/20 0.41
ESR1 P03372 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
TSHR P16473 1/20 0.40
CYP2C19 P33261 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
SCHEMBL3255521 0.92 PKM (0.48) HCRTR2HCRTR1PKMPOLBMCOLN3
SCHEMBL3255886 0.90 PKM (0.48) HCRTR2HCRTR1PKMPOLBMCOLN3
SCHEMBL3252995 0.90 PKM (0.47) HCRTR2HCRTR1PKMPOLBMCOLN3
SCHEMBL3254966 0.90 PKM (0.47) HCRTR2HCRTR1PKMPOLBMCOLN3
SCHEMBL3251551 0.90 HCRTR2 (0.49) HCRTR2HCRTR1PKMPOLBMCOLN3
SCHEMBL3251964 0.90 PKM (0.49) HCRTR2HCRTR1PKMPOLBMCOLN3
SCHEMBL3243770 0.90 PKM (0.47) HCRTR2HCRTR1PKMPOLBMCOLN3
SCHEMBL3255534 0.89 HCRTR2 (0.45) HCRTR2HCRTR1PKMPOLBMCOLN3
SCHEMBL3256098 0.89 PKM (0.47) HCRTR2HCRTR1PKMPOLBMCOLN3
SCHEMBL3256512 0.89 PKM (0.56) HCRTR2HCRTR1PKMPOLBMCOLN3

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
EP-1776347-B1 SULPHONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI AVENTIS (FR) 2010-05-26 EP disclosed
WO-2006024779-A1 SULPHONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI-AVENTIS (FR) 2006-03-09 WO disclosed