SCHEMBL8720683

SCHEMBL8720683

C=C(COCCCC)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
RECQL P46063 1/20 0.42
LTA4H P09960 2/20 0.42
LMNA P02545 1/20 0.41
PTGS2 P35354 1/20 0.41
ALDH1A1 P00352 2/20 0.40
CES2 O00748 2/20 0.40
CES1 P23141 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
RARB P10826 1/20 0.39
HPGD P15428 1/20 0.39
PLA2G4B P0C869 3/20 0.38

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
SCHEMBL28683415 0.97 TSHR (0.43) TSHRRECQLLTA4HLMNAPTGS2
SCHEMBL27591320 0.95 LTA4H (0.42) TSHRLTA4HLMNAPTGS2ALDH1A1
SCHEMBL8945483 0.93 CES2 (0.44) TSHRLTA4HLMNAALDH1A1CES2
SCHEMBL21596565 0.93 CES2 (0.44) TSHRLTA4HLMNAALDH1A1CES2
SCHEMBL7061572 0.93 CES2 (0.44) TSHRLTA4HLMNAALDH1A1CES2
SCHEMBL21596569 0.93 CES2 (0.44) TSHRLTA4HLMNAALDH1A1CES2
SCHEMBL22758881 0.87 RARB (0.46) TSHRRECQLLMNARARBPLA2G4B
SCHEMBL28705220 0.86 LMNA (0.44) LMNAALDH1A1CES2CES1MAOA
SCHEMBL22758857 0.85 GAA (0.43) TSHRRECQLLMNARARBHPGD
SCHEMBL9444019 0.84 TSHR (0.42) TSHRLTA4HLMNAPTGS2ALDH1A1

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-4456216-A1 POLYELECTROLYTE MEMBRANE HAVING, AS BASE THEREFOR, POLYMER HAVING HIGH DENSITY OF ACIDIC FUNCTIONAL GROUPS National University Corporation Tokai National Higher Education and Research System (JP) 2024-10-30 EP disclosed
WO-2023120731-A1 POLYELECTROLYTE MEMBRANE HAVING, AS BASE THEREFOR, POLYMER HAVING HIGH DENSITY OF ACIDIC FUNCTIONAL GROUPS 国立大学法人東海国立大学機構 2023-06-29 WO disclosed
WO-1998029396-A1 HETEROCYCLIC AROMATIC ANION SALTS, AND THEIR USES AS IONIC CONDUCTING MATERIALS HYDRO-QUEBEC (CA) 1998-07-09 WO disclosed
US-5393625-A Electroconductive support, zinc oxide photoconductor, dye and binder resin FUJI PHOTO FILM CO., LTD. (JP) 1995-02-28 US disclosed