SCHEMBL8414397

SCHEMBL8414397

CC1c2ccccc2-c2cccc([Cr]c3cccc4c3C(C)c3ccccc3-4)c21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.38
HTR2A P28223 1/20 0.33
HTR7 P34969 1/20 0.33
HTR2B P41595 1/20 0.33
POLB P06746 2/20 0.32
HTR1A P08908 2/20 0.32
ACHE P22303 2/20 0.32
CHRM2 P08172 1/20 0.32
ADRA2A P08913 1/20 0.32
CHRM1 P11229 1/20 0.32
DRD1 P21728 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
ADRA1A P35348 1/20 0.32
OPRM1 P35372 1/20 0.32
DRD3 P35462 1/20 0.32
SLC6A3 Q01959 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
DRD2 P14416 2/20 0.31
DRD4 P21917 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
SCHEMBL358532 0.78 GPR3 (0.39) GPR3HTR2AHTR7HTR2BACHE
SCHEMBL31338566 0.78 GPR3 (0.39) GPR3HTR2AHTR7HTR2BACHE
SCHEMBL29285278 0.76 ALDH1A1 (0.41) GPR3HTR2AHTR7HTR2BPOLB
SCHEMBL28807674 0.76 GPR3 (0.38) GPR3HTR2AHTR7HTR2BPOLB
SCHEMBL30987013 0.76 ALDH1A1 (0.41) GPR3HTR2AHTR7HTR2BPOLB
SCHEMBL12429503 0.76 GPR3 (0.38) GPR3HTR2AHTR7HTR2BHTR1A
SCHEMBL40599 0.75 GPR3 (0.52) GPR3HTR2AHTR7HTR2BPOLB
SCHEMBL29641604 0.75 GPR3 (0.52) GPR3HTR2AHTR7HTR2BPOLB
SCHEMBL6558630 0.74 GPR3 (0.36) GPR3HTR2AHTR7HTR2BPOLB
Methyl Alcohol SCHEMBL14815699 0.74 ALDH1A1 (0.38) GPR3HTR7HTR2BPOLBACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112552437-B Chromium-molybdenum double-center supported catalyst and preparation method and application thereof 中国石油天然气股份有限公司 2022-12-02 CN disclosed
CN-112552437-A Chromium-molybdenum double-center supported catalyst and preparation method and application thereof 中国石油天然气股份有限公司 2021-03-26 CN disclosed
CN-112552435-A Double-center supported catalyst and preparation method and application thereof 中国石油天然气股份有限公司 2021-03-26 CN disclosed
EP-0627440-B1 Metallocenes containing 9-substituted fluorenyl compounds and use of the metallocenes PHILLIPS PETROLEUM CO (US) 1999-08-18 EP disclosed
US-4015059-A Fused ring catalyst and ethylene polymerization process therewith UNION CARBIDE CORPORATION (US) 1977-03-29 US disclosed