SCHEMBL334729

SCHEMBL334729

CCN(CCN)[C@@H](C)c1ccc(F)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 1/20 0.39
AOC3 Q16853 3/20 0.38
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
TAAR1 Q96RJ0 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
IDO1 P14902 2/20 0.33
TDO2 P48775 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HPGD P15428 1/20 0.33
GABBR2 O75899 1/20 0.33
GABBR1 Q9UBS5 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.32

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
SCHEMBL335352 0.84 ALOX5 (0.42) MAOAMAOBTAAR1NPSR1
SCHEMBL335079 0.83 TAAR1 (0.42) TAAR1HPGD
SCHEMBL334958 0.83 ALOX5 (0.44) MAOASLC6A2SLC6A4SLC6A3TAAR1
SCHEMBL335097 0.83 ADRB2 (0.42) AOC3SLC6A2SLC6A4SLC6A3TAAR1
SCHEMBL335260 0.82 HRH1 (0.45) AOC3SLC6A4SLC6A3TAAR1
SCHEMBL335096 0.82 PDE2A (0.41) MAOBSLC6A2SLC6A4SLC6A3TAAR1
SCHEMBL334403 0.81 AOC3 (0.41) AOC3SLC6A2SLC6A4TAAR1IDO1
SCHEMBL334241 0.80 ALOX5 (0.43) AOC3MAOAMAOBSLC6A4TAAR1
SCHEMBL334298 0.79 SMN1; SMN2 (0.34) ROCK1LOXL2
SCHEMBL334377 0.79 NQO1 (0.44) MEN1KMT2A

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
US-8097708-B2 10a-Azalide compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-17 US disclosed
US-20090281292-A1 10a-Azalide Compound MEIJI SEIKA PHARMA CO., LTD. (JP) 2009-11-12 US disclosed
EP-1985620-A1 10a-AZALIDE COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2008-10-29 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090281292-A1 10a-Azalide Compound IL17A, AZI2, HDAC9 ROCK1 239/4885AOC3 4508/4885MAOA 1474/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.