SCHEMBL335187

SCHEMBL335187

C#CCOC(=O)N(C)C1CO1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
NPC1 O15118 1/20 0.33
TSHR P16473 1/20 0.31
CYP1A2 P05177 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CYP2D6 P10635 1/20 0.31
CHRM1 P11229 1/20 0.31
NFKB1 P19838 1/20 0.31
CHRM3 P20309 1/20 0.31
THPO P40225 1/20 0.31
BCHE P06276 1/20 0.31
LMNA P02545 1/20 0.31
PMP22 Q01453 1/20 0.31

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
SCHEMBL7211908 0.73
SCHEMBL2749993 0.71
SCHEMBL28954012 0.71 NPC1 (0.36) POLBNPC1TSHRCYP1A2CHRM2
SCHEMBL5546397 0.69 HTR2A (0.42) LMNA
SCHEMBL24722063 0.68 NPC1 (0.37) NPC1TSHRCYP1A2CHRM2CHRM4
SCHEMBL21205900 0.68 NPC1 (0.37) POLBNPC1TSHRCYP1A2CHRM2
SCHEMBL2279111 0.67 ASGR1 (0.43) CHRM2CHRM1NFKB1CHRM3
SCHEMBL5542844 0.66 HTR2A (0.42) TSHRCYP1A2
SCHEMBL27969641 0.66 NPC1 (0.44) POLBNPC1TSHRCYP1A2BCHE
SCHEMBL10387999 0.66 TSHR (0.50) POLBNPC1TSHRCYP1A2CHRM2

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 POLB 3348/4885NPC1 209/4885TSHR 1567/4885

“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.