SCHEMBL1759663

SCHEMBL1759663

O=C1CCNc2cc3c(cc2CN1)OCO3

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.51
CRBN Q96SW2 1/20 0.35
ACHE P22303 1/20 0.34
ALDH1A1 P00352 3/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2C19 P33261 2/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 1/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CHRNA7 P36544 1/20 0.32
CYP2D6 P10635 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL5568453 0.81 KDM4E (0.58) KDM4EALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL31019369 0.78 KDM4E (0.47) KDM4ECRBNALDH1A1CYP1A2CYP2C19
SCHEMBL9093659 0.74 KDM4E (0.46) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL9739665 0.71 KDM4E (0.60) KDM4ECRBNACHEALDH1A1CYP1A2
SCHEMBL1759498 0.71 KDM4E (0.42) KDM4EALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL29433775 0.69 CA9 (0.47) KDM4EALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL9092910 0.69 CA9 (0.47) KDM4EALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL2061212 0.69 CA9 (0.44) KDM4ECRBNALDH1A1LMNAMAPT
SCHEMBL12079122 0.69 PARP10 (0.46) KDM4ECRBNMAPT
Noroxyhydrastinine SCHEMBL564339 0.68 KDM4E (1.00) KDM4EACHECYP2D6

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8765728-B2 [1,5]-diazocin derivatives MELLITECH (FR) 2014-07-01 US disclosed
EP-2501685-A1 [1,5]-DIAZOCIN DERIVATIVES Mellitech (FR) 2012-09-26 EP disclosed
US-20120225892-A1 [1,5]-Diazocin Derivatives MELLITECH (FR) 2012-09-06 US disclosed
WO-2011058193-A1 [1,5]-DIAZOCIN DERIVATIVES MELLITECH (FR) 2011-05-19 WO 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-20120225892-A1 [1,5]-Diazocin Derivatives IAPP, INSR, GLP1R KDM4E 3585/4885CRBN 3374/4885ACHE 2545/4885

“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.