SCHEMBL334619

SCHEMBL334619

CCN(CCN)C(C)c1cccc(-n2cnnn2)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
NOTUM Q6P988 3/20 0.42
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
PTGS2 P35354 1/20 0.38
IDE P14735 1/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL10244429 0.80 TP53 (0.49) LMNATP53KMT2AKDM4EUSP2
SCHEMBL29337463 0.76 NOTUM (0.53) LMNANOTUMALDH1A1TP53PTGS2
SCHEMBL7994431 0.76 NOTUM (0.65) LMNANOTUMALDH1A1TP53PTGS2
SCHEMBL335068 0.74 AOC3 (0.40) KDM4E
SCHEMBL1132949 0.72 OPRK1 (0.53) LMNAALDH1A1KDM4E
SCHEMBL334403 0.72 AOC3 (0.41)
SCHEMBL335051 0.72 AOC3 (0.41)
Hydrochloric Acid SCHEMBL31500336 0.71 AOC3 (0.40)
Hydrochloric Acid SCHEMBL30606596 0.71 AOC3 (0.40)
SCHEMBL334856 0.71 GBA1 (0.36) ALDH1A1KDM4E

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 LMNA 1467/4885NOTUM 2599/4885ALDH1A1 1939/4885

“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.