SCHEMBL334241

SCHEMBL334241

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

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
ALDH1A1 P00352 1/20 0.43
AOC3 Q16853 5/20 0.41
TAAR1 Q96RJ0 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
ACHE P22303 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SLC6A4 P31645 1/20 0.39

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
SCHEMBL334377 0.86 NQO1 (0.44) ALDH1A1MEN1KMT2A
SCHEMBL335816 0.82 AOC3 (0.46) AOC3TAAR1ACHESLC6A4
SCHEMBL334526 0.82 AOC3 (0.46) AOC3TAAR1ACHESLC6A4
SCHEMBL335352 0.81 ALOX5 (0.42) ALOX5TAAR1CYP1A2ACHEMAOA
SCHEMBL334958 0.80 ALOX5 (0.44) ALOX5ALDH1A1TAAR1CYP2D6MAOA
SCHEMBL335097 0.80 ADRB2 (0.42) ALDH1A1AOC3TAAR1CYP1A2CYP2D6
SCHEMBL335079 0.80 TAAR1 (0.42) ALOX5ALDH1A1TAAR1
SCHEMBL334729 0.80 ROCK1 (0.39) AOC3TAAR1MAOAMAOBMEN1
SCHEMBL10779533 0.80 AOC3 (0.45) ALOX5ALDH1A1AOC3CYP1A2CYP2D6
SCHEMBL335260 0.80 HRH1 (0.45) ALOX5AOC3TAAR1CYP1A2CYP2D6

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 ALOX5 2387/4885ALDH1A1 1939/4885AOC3 4508/4885

“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.