SCHEMBL335344

SCHEMBL335344

C=CCNC(=O)OCCOCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.52
LMNA P02545 1/20 0.52
TGM2 P21980 1/20 0.48
MAPT P10636 1/20 0.47
GAA P10253 1/20 0.46
TEAD3 Q99594 1/20 0.45
HTT P42858 2/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
RECQL P46063 1/20 0.44
FAAH O00519 2/20 0.44
MGLL Q99685 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL195242 0.86 TGM2 (0.61) SMN1; SMN2LMNATGM2MAPTHTT
SCHEMBL10244942 0.81 SMN1; SMN2 (0.56) SMN1; SMN2LMNAMAPTHTTNPC1
SCHEMBL21570876 0.79 TSHR (0.48) SMN1; SMN2MAPTHTTRAB9AFAAH
SCHEMBL3443629 0.79 NPC1 (0.69) SMN1; SMN2LMNAMAPTNPC1RAB9A
SCHEMBL28631639 0.78 TGM2 (0.44) SMN1; SMN2LMNATGM2MAPTGAA
SCHEMBL23111386 0.78 TSHR (0.46) SMN1; SMN2MAPTHTTRAB9AFAAH
SCHEMBL318098 0.77 THRB (0.61) SMN1; SMN2LMNATEAD3ALDH1A1
SCHEMBL9068033 0.77 CASP1 (0.55) SMN1; SMN2LMNATGM2MAPTALDH1A1
SCHEMBL9825023 0.77 ALDH1A1 (0.55) SMN1; SMN2LMNATGM2GAAHTT
SCHEMBL97680 0.76 NPC1 (0.57) SMN1; SMN2LMNAMAPTNPC1RAB9A

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 SMN1; SMN2 3120/4885LMNA 1467/4885TGM2 4692/4885

“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.