SCHEMBL335260

SCHEMBL335260

CCN(CCN)[C@@H](C)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 5/20 0.45
SIGMAR1 Q99720 1/20 0.44
TAAR1 Q96RJ0 4/20 0.44
HTR2A P28223 5/20 0.42
ALOX5 P09917 1/20 0.41
PGR P06401 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
KCNH2 Q12809 1/20 0.40
AOC3 Q16853 2/20 0.39
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
PRMT8 Q9NR22 1/20 0.39
SLC7A5 Q01650 1/20 0.36
OPRD1 P41143 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL529713 0.84 SIGMAR1 (0.48) HRH1SIGMAR1TAAR1HTR2AALOX5
SCHEMBL335352 0.84 ALOX5 (0.42) TAAR1ALOX5CYP1A2TSHR
SCHEMBL15131012 0.83 HRH1 (0.57) HRH1SIGMAR1HTR2AALOX5PGR
SCHEMBL28729975 0.83 OPRD1 (0.50) HRH1SIGMAR1TAAR1HTR2APGR
SCHEMBL335097 0.82 ADRB2 (0.42) HRH1TAAR1HTR2AADRA2BKCNH2
SCHEMBL334958 0.82 ALOX5 (0.44) HRH1TAAR1HTR2AALOX5ADRA2A
SCHEMBL335079 0.82 TAAR1 (0.42) TAAR1ALOX5TSHR
SCHEMBL334729 0.82 ROCK1 (0.39) TAAR1AOC3SLC6A4SLC6A3
SCHEMBL334298 0.82 SMN1; SMN2 (0.34) CYP3A4CYP2D6TSHRCYP2C19
SCHEMBL335068 0.82 AOC3 (0.40) TAAR1AOC3TSHR

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 HRH1 1680/4885SIGMAR1 3998/4885TAAR1 4408/4885

“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.