SCHEMBL1858833

SCHEMBL1858833

CCC(C)Cc1ccc(O)cc1-c1cc(C)cc(C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 2/20 0.38
PGR P06401 2/20 0.38
NR3C2 P08235 2/20 0.38
AKR1C3 P42330 2/20 0.35
AKR1C2 P52895 2/20 0.35
TYR P14679 4/20 0.34
ALOX15 P16050 2/20 0.34
ALOX12 P18054 1/20 0.34
CNR1 P21554 4/20 0.34
CNR2 P34972 4/20 0.34
ESR1 P03372 3/20 0.33
ESR2 Q92731 3/20 0.33
PTGS2 P35354 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALOX5 P09917 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL1857743 0.80 ANPEP (0.41) NR3C1PGRNR3C2AKR1C3AKR1C2
SCHEMBL726424 0.79 CNR1 (0.40) TYRCNR1CNR2ESR1ESR2
SCHEMBL1858269 0.78 TYR (0.43) TYRALOX15CNR1CNR2ESR1
SCHEMBL1857824 0.74 CYP3A4 (0.57) TYRALOX15CNR1CNR2ESR1
SCHEMBL14647066 0.74 ALOX15 (0.44) NR3C1PGRNR3C2TYRALOX15
SCHEMBL27749858 0.73 BACE1 (0.43) NR3C1PGRNR3C2AKR1C3AKR1C2
SCHEMBL11226374 0.72 TYR (0.42) PGRTYRALOX15ESR1ESR2
SCHEMBL27566464 0.72 CNR1 (0.44) TYRALOX15CNR1CNR2ESR2
SCHEMBL1021533 0.70 TYR (0.40) TYRCNR1CNR2ESR1ESR2
SCHEMBL24618061 0.69 ALOX15 (0.39) PGRTYRALOX15ESR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108291122-B Anionically curable compositions 设计分子有限公司 2021-01-05 CN disclosed
EP-2129820-B1 USE OF COAL COMBUSTION FLUE GAS FILTERS SOLVAY ADVANCED POLYMERS LLC (US) 2011-05-25 EP disclosed
EP-2129820-A2 COAL COMBUSTION FLUE GAS FILTERS Solvay Advanced Polymers, L.L.C. (US) 2009-12-09 EP disclosed
CN-100548666-C Multilayer composite with special visual effect GEN ELECTRIC (NL) 2009-10-14 CN disclosed
WO-2008116606-A2 COAL COMBUSTION FLUE GAS FILTERS SOLVAY ADVANCED POLYMERS, L.L.C. (US) 2008-10-02 WO disclosed
WO-2008116837-A2 POLYMER FIBERS, ASSEMBLIES INCORPORATING SUCH POLYMER FIBERS, AND SYSTEMS INCORPORATING SUCH FILTER ASSEMBLIES SOLVAY ADVANCED POLYMERS, L.L.C. (US) 2008-10-02 WO disclosed
CN-1968809-A Multilayer composites with special visual effects GEN ELECTRIC (US) 2007-05-23 CN disclosed