SCHEMBL27619062

SCHEMBL27619062

CCCCC1c2ccccc2-c2cccc([Hf])c21

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.42
BCHE P06276 1/20 0.42
HTR2A P28223 1/20 0.39
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CHRM2 P08172 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33
CHRM1 P11229 1/20 0.33
DRD1 P21728 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
ADRA1A P35348 1/20 0.33
OPRM1 P35372 1/20 0.33
DRD3 P35462 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33

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
SCHEMBL27638219 0.92 HTR2A (0.40) ACHEBCHEHTR2ACA1CA2
SCHEMBL313685 0.80 ACHE (0.55) ACHEBCHEHTR2ACA1CA2
SCHEMBL2274491 0.80 ACHE (0.40) ACHEBCHEHTR2ACHRM2HTR1A
SCHEMBL815385 0.79 ACHE (0.41) ACHEBCHEHTR2ACHRM2HTR1A
SCHEMBL30638595 0.79 ACHE (0.41) ACHEBCHEHTR2ACHRM2HTR1A
SCHEMBL2672463 0.79 BCHE (0.41) ACHEBCHEHTR2A
Hydrochloric Acid SCHEMBL2274495 0.78 ACHE (0.41) ACHEBCHEHTR2ACHRM2HTR1A
Hydrochloric Acid SCHEMBL4307264 0.77 ACHE (0.40) ACHEBCHEHTR2ACHRM2HTR1A
SCHEMBL27741321 0.75 HTR2A (0.41) ACHEBCHEHTR2A
SCHEMBL27930894 0.75 HTR2A (0.41) ACHEBCHEHTR2A

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-102124151-B Bicomponent spunbond fiber and supunbond fabric prepared therefrom FINA TECHNOLOGY 2013-08-21 CN disclosed
CN-101827866-B Multi-component catalyst system and polymerization process for in situ formation of heterophasic copolymers and/or modification of xylene solubles content of polyolefins FINA TECHNOLOGY 2013-03-06 CN disclosed
CN-101568607-B Radiation-resistant polypropylene material FINA TECHNOLOGY 2012-04-25 CN disclosed
CN-101568607-A Radiation-resistant polypropylene material FINA TECHNOLOGY (US) 2009-10-28 CN disclosed
CN-1708516-A Synthesis of polymerization catalyst components UNIVATION TECH LLC (US) 2005-12-14 CN disclosed