SCHEMBL2806552

SCHEMBL2806552

CCCCCCCCc1cc(Cl)c(O)c(-c2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.46
TRPV1 Q8NER1 1/20 0.44
AKR1C2 P52895 1/20 0.44
AKR1C1 Q04828 1/20 0.44
CYP3A4 P08684 2/20 0.44
HSD11B1 P28845 1/20 0.43
ESR1 P03372 2/20 0.42
ADRA2A P08913 2/20 0.42
ADORA3 P0DMS8 2/20 0.42
TACR2 P21452 2/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
SHBG P04278 1/20 0.42
TP53 P04637 1/20 0.42
HSPD1 P10809 1/20 0.42
ADRB3 P13945 1/20 0.42

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
SCHEMBL8745386 0.90 PTGS2 (0.53) PTGS2TRPV1CYP3A4HSD11B1ESR1
SCHEMBL202228 0.90 PTGS2 (0.53) PTGS2TRPV1CYP3A4HSD11B1ESR1
SCHEMBL27613247 0.88 CNR1 (0.43) AKR1C2AKR1C1ACLY
SCHEMBL580774 0.88 PTPN1 (0.45) AKR1C2AKR1C1ALDH1A1HSD17B10ACLY
SCHEMBL27393953 0.84 RARB (0.48) PTGS2TRPV1CYP3A4HSD11B1ESR1
SCHEMBL27465029 0.84 RARB (0.48) PTGS2TRPV1CYP3A4HSD11B1ESR1
SCHEMBL27415111 0.84 RARB (0.48) PTGS2TRPV1CYP3A4HSD11B1ESR1
SCHEMBL27391199 0.84 RARB (0.48) PTGS2TRPV1CYP3A4HSD11B1ESR1
SCHEMBL27415106 0.84 RARB (0.48) PTGS2TRPV1CYP3A4HSD11B1ESR1
SCHEMBL27480117 0.84 RARB (0.48) PTGS2TRPV1CYP3A4HSD11B1ESR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2207416-B1 ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM IMERYS FILTRATION MINERALS INC (US) 2018-11-07 EP disclosed
US-20100239679-A1 ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM WORLD MINERALS, INC. (US) 2010-09-23 US disclosed
EP-2207416-A1 ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM World Minerals, Inc. (US) 2010-07-21 EP disclosed
WO-2009045941-A1 ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM WORLD MINERALS, INC. (US) 2009-04-09 WO disclosed