SCHEMBL335503

SCHEMBL335503

O=C1OCCN1CCC1CO1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
TP53 P04637 1/20 0.36
HBB P68871 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PIK3CD O00329 1/20 0.36
CNR2 P34972 2/20 0.34
LTA4H P09960 1/20 0.34
CNR1 P21554 1/20 0.34
PER2 O15055 1/20 0.34
CRY2 Q49AN0 1/20 0.34
GRM2 Q14416 1/20 0.34
NQO2 P16083 1/20 0.34
HTR1A P08908 1/20 0.31
DRD4 P21917 1/20 0.31
HTR1B P28222 1/20 0.31
DRD3 P35462 1/20 0.31
NAAA Q02083 1/20 0.31
PIM1 P11309 3/20 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
SCHEMBL334640 0.89 KDM4E (0.42) KDM4ETP53HBBSMN1; SMN2PIK3CD
SCHEMBL334938 0.81 TP53 (0.48) KDM4ETP53HBBSMN1; SMN2PIK3CD
SCHEMBL17599198 0.79 PIM1 (0.40) TP53HBBSMN1; SMN2PIM1
SCHEMBL17599202 0.76 MAPT (0.43) KDM4ETP53HBBSMN1; SMN2PER2
SCHEMBL1712876 0.74
SCHEMBL15870256 0.74 ACHE (0.45) KDM4EPIK3CDCNR2CNR1GRM2
SCHEMBL19233537 0.73 KDM4E (0.46) KDM4ESMN1; SMN2PIK3CDCNR2CNR1
SCHEMBL15864247 0.73 KDM4E (0.40) KDM4EGRM2NAAAPIM1
SCHEMBL2037199 0.72
SCHEMBL7625881 0.72

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 KDM4E 128/4885TP53 3887/4885HBB 687/4885

“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.