SCHEMBL7535293

SCHEMBL7535293

OC1CCc2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.46
ANPEP P15144 1/20 0.42
IDO1 P14902 3/20 0.40
PDPK1 O15530 1/20 0.40
PLAU P00749 1/20 0.39
SLC18A3 Q16572 1/20 0.39
CES1 P23141 1/20 0.39
CYP11B2 P19099 1/20 0.38
NR3C2 P08235 1/20 0.38
CHRM4 P08173 1/20 0.38
HTR7 P34969 1/20 0.38
CYP3A4 P08684 1/20 0.38
TDO2 P48775 1/20 0.38
NOS3 P29474 1/20 0.37
NOS2 P35228 1/20 0.37

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
SCHEMBL269510 0.89 IDO1 (0.43) HTR2AIDO1
SCHEMBL21114381 0.83 IDO1 (0.50) HTR2AIDO1PDPK1SLC18A3CYP11B2
SCHEMBL1355960 0.83 IDO1 (0.50) HTR2AIDO1PDPK1SLC18A3CYP11B2
SCHEMBL3418678 0.83 IDO1 (0.50) HTR2AIDO1PDPK1SLC18A3CYP11B2
SCHEMBL29544390 0.83 IDO1 (0.50) HTR2AIDO1PDPK1SLC18A3CYP11B2
SCHEMBL57132 0.83 IDO1 (0.50) HTR2AIDO1PDPK1SLC18A3CYP11B2
SCHEMBL29457637 0.83 IDO1 (0.50) HTR2AIDO1PDPK1SLC18A3CYP11B2
Hydrochloric Acid SCHEMBL3940929 0.81 IDO1 (0.52) ANPEPIDO1PDPK1SLC18A3CYP11B2
Ammonia Solution, Strong SCHEMBL6419944 0.81 IDO1 (0.48) IDO1PDPK1SLC18A3CYP11B2CHRM4
SCHEMBL14870745 0.81 HTR2A (0.55) HTR2ANOS3NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111909196-B IVB-group-containing bimetallic complex catalyst, and preparation method and application thereof 万华化学集团股份有限公司 2023-05-26 CN claimed
CN-117263897-A Chiral dibenzosubenol compound and asymmetric synthesis method thereof 四川师范大学 2023-12-22 CN disclosed
CN-117263897-A Chiral dibenzosubenol compound and asymmetric synthesis method thereof 四川师范大学 2023-12-22 CN disclosed
CN-114315883-B Dibenzofuran phenol IVB metal complex and preparation method thereof, catalyst system and olefin polymerization method 万华化学集团股份有限公司 2023-10-20 CN disclosed
CN-111909196-B IVB-group-containing bimetallic complex catalyst, and preparation method and application thereof 万华化学集团股份有限公司 2023-05-26 CN disclosed
WO-2002030897-A2 COMPOSITIONS AND METHODS FOR REGULATING THE NERVOUS SYSTEM FILLION GILLES (FR) 2002-04-18 WO disclosed