SCHEMBL29596197

SCHEMBL29596197

C[Si](C)(Cl)C1c2ccccc2-c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.43
SLC22A2 O15244 1/20 0.38
SLC22A3 O75751 1/20 0.38
HTR2A P28223 1/20 0.38
POLB P06746 2/20 0.36
ACHE P22303 2/20 0.35
CHRM2 P08172 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
CHRM1 P11229 1/20 0.35
DRD1 P21728 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
ADRA1A P35348 1/20 0.35
OPRM1 P35372 1/20 0.35
DRD3 P35462 1/20 0.35
SLC6A3 Q01959 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL2480013 1.00 GPR3 (0.43) GPR3SLC22A2SLC22A3HTR2APOLB
SCHEMBL7048563 0.86 GPR3 (0.43) GPR3SLC22A2SLC22A3HTR2APOLB
SCHEMBL7056977 0.86 GPR3 (0.43) GPR3SLC22A2SLC22A3HTR2APOLB
SCHEMBL30390148 0.80 GPR3 (0.46) GPR3SLC22A2SLC22A3HTR2APOLB
SCHEMBL2546783 0.80 GPR3 (0.41) GPR3SLC22A2SLC22A3HTR2APOLB
SCHEMBL23211689 0.80 GPR3 (0.41) GPR3SLC22A2SLC22A3HTR2APOLB
SCHEMBL6671925 0.80 GPR3 (0.46) GPR3SLC22A2SLC22A3HTR2APOLB
SCHEMBL5981387 0.80 GPR3 (0.46) GPR3SLC22A2SLC22A3HTR2APOLB
SCHEMBL5175634 0.80 GPR3 (0.46) GPR3SLC22A2SLC22A3HTR2APOLB
SCHEMBL8970979 0.79 GPR3 (0.38) GPR3SLC22A2SLC22A3HTR2APOLB

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
CN-114401977-B Transition metal compound and catalyst composition comprising the same 株式会社LG化学 2024-08-02 CN disclosed
CN-114401977-A Transition metal compound and catalyst composition comprising the same 株式会社LG化学 2022-04-26 CN disclosed