SCHEMBL11228865

SCHEMBL11228865

Clc1ccc(CCOCCc2ccc(Cl)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.54
SLC6A2 P23975 2/20 0.49
HRH1 P35367 2/20 0.49
HRH3 Q9Y5N1 2/20 0.49
SLC6A4 P31645 2/20 0.49
CHRM2 P08172 1/20 0.49
ADRA2C P18825 1/20 0.49
SLC6A3 Q01959 1/20 0.49
KCNH2 Q12809 1/20 0.49
CACNA1C Q13936 1/20 0.49
SCN5A Q14524 1/20 0.49
CHRM4 P08173 1/20 0.47
HTR2C P28335 1/20 0.47
HTR7 P34969 1/20 0.47
TMEM97 Q5BJF2 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
MAOB P27338 3/20 0.46
IDO1 P14902 3/20 0.46
AGXT P21549 2/20 0.46
AOC3 Q16853 1/20 0.45

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
SCHEMBL9021254 0.89 TAAR1 (0.45) TAAR1SLC6A2HRH1HRH3SLC6A4
SCHEMBL8346410 0.89 TAAR1 (0.61) TAAR1SLC6A2HRH1HRH3SLC6A4
SCHEMBL9613957 0.89 TAAR1 (0.45) TAAR1SLC6A2HRH1HRH3SLC6A4
SCHEMBL3169926 0.89 TAAR1 (0.45) TAAR1SLC6A2HRH1HRH3SLC6A4
SCHEMBL5979175 0.86 TAAR1 (0.46) TAAR1SLC6A2HRH1HRH3SLC6A4
SCHEMBL10793624 0.86 KDM4E (0.56) TAAR1SLC6A2HRH1HRH3SLC6A4
SCHEMBL2094863 0.85 SLC6A2 (0.47) TAAR1SLC6A2HRH1HRH3SLC6A4
SCHEMBL9249000 0.85 SLC6A2 (0.64) TAAR1SLC6A2HRH1HRH3SLC6A4
SCHEMBL9021284 0.84 SLC6A2 (0.46) TAAR1SLC6A2HRH1HRH3SLC6A4
SCHEMBL9021024 0.82 KCNH2 (0.45) TAAR1SLC6A2HRH1HRH3SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115286493-A Preparation method of 4,4' -diethoxybiphenyl 北京格林凯默科技有限公司 2022-11-04 CN disclosed
US-4336267-A Heart active compounds and methods of use AKTIEBOLAGET HASSLE (SE) 1982-06-22 US disclosed
US-4244969-A (P-HYDROXYPHENOXY)PROPANOLAMINE DERIVATIVES USEFUL AS B-RECEPTOR STIMULANTS AKTIEBOLAGET HASSLE (SE) 1981-01-13 US disclosed