SCHEMBL334543

SCHEMBL334543

N#Cc1cccc(CN(C[C@@H]2CO2)C(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEP1A Q16819 1/20 0.47
MEP1B Q16820 1/20 0.47
PTGES O14684 6/20 0.46
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
OXTR P30559 1/20 0.43
AVPR1A P37288 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
USP2 O75604 1/20 0.43
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
SNCA P37840 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
LMNA P02545 1/20 0.40
NPC1 O15118 1/20 0.40
MGLL Q99685 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
SCHEMBL334445 0.82 MEN1 (0.50) OXTRAVPR1AMEN1KMT2ALMNA
SCHEMBL334420 0.81 PTGES (0.51) PTGESMEN1KMT2ACHRM2CHRM1
SCHEMBL2773062 0.78 MEP1B (0.52) MEP1AMEP1BPTGESSLC6A2SLC6A4
SCHEMBL334949 0.77 ALDH1A1 (0.52) MEN1KMT2ALMNANPC1
SCHEMBL2774324 0.76 MEP1A (0.48) MEP1AMEP1BPTGESSLC6A2SLC6A4
SCHEMBL6566687 0.75 SLC6A2 (0.55) MEP1AMEP1BPTGESSLC6A2SLC6A4
SCHEMBL6566756 0.75 MEP1A (0.50) MEP1AMEP1BPTGESMEN1KMT2A
SCHEMBL16644940 0.74 OXTR (0.40) OXTRAVPR1AMEN1KMT2ACHRM2
SCHEMBL335041 0.73 KMT2A (0.50) MEN1KMT2ALMNA
SCHEMBL11160181 0.73 OXTR (0.53) OXTRAVPR1AMEN1KMT2A

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 MEP1A 17/4885MEP1B 39/4885PTGES 4326/4885

“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.