SCHEMBL334640

SCHEMBL334640

O=C1OCCN1CCCC1CO1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
TP53 P04637 1/20 0.34
HBB P68871 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PIK3CD O00329 1/20 0.34
CNR2 P34972 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CNR1 P21554 1/20 0.33
NAAA Q02083 2/20 0.33
NQO2 P16083 1/20 0.33
PER2 O15055 1/20 0.33
CRY2 Q49AN0 1/20 0.33
GRM2 Q14416 1/20 0.33
NR1H2 P55055 1/20 0.32
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KMT2A Q03164 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
SCHEMBL335503 0.89 KDM4E (0.44) KDM4ETP53HBBSMN1; SMN2PIK3CD
SCHEMBL334938 0.78 TP53 (0.48) KDM4ETP53HBBSMN1; SMN2PIK3CD
SCHEMBL7286766 0.77 NAAA (0.56) KDM4EPIK3CDNAAAGRM2
SCHEMBL15864216 0.74 NAAA (0.41) KDM4ENAAAGRM2
SCHEMBL4573839 0.74 NAAA (0.49) KDM4ETP53SMN1; SMN2PIK3CDCNR2
SCHEMBL15111451 0.74 KDM4E (0.46) KDM4ESMN1; SMN2PIK3CDCNR2ALDH1A1
SCHEMBL2065643 0.74 KDM4E (0.50) KDM4EPIK3CDCNR2ALDH1A1CNR1
SCHEMBL16377754 0.74 KDM4E (0.46) KDM4EPIK3CDCNR2ALDH1A1CNR1
SCHEMBL1031978 0.74 KDM4E (0.46) KDM4EPIK3CDCNR2ALDH1A1CNR1
SCHEMBL4035621 0.74 KDM4E (0.46) KDM4EPIK3CDCNR2ALDH1A1CNR1

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.