SCHEMBL4380573

SCHEMBL4380573

COc1cc(C=CC(=O)N2CCN(C3CCCC3)CC2)ccc1OCc1ccccc1

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
APP P05067 20/20 0.79
KDM4E B2RXH2 1/20 0.72
MEN1 O00255 1/20 0.72
HPGD P15428 1/20 0.72
KMT2A Q03164 1/20 0.72
SMN1; SMN2 Q16637 1/20 0.72

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
SCHEMBL14190936 1.00 APP (0.79) APPKDM4EMEN1HPGDKMT2A
SCHEMBL4381093 0.99 APP (0.79) APPKDM4EMEN1HPGDKMT2A
SCHEMBL14190926 0.99 APP (0.79) APPKDM4EMEN1HPGDKMT2A
SCHEMBL2830260 0.93 APP (0.82) APPKDM4EMEN1HPGDKMT2A
SCHEMBL3780737 0.92 APP (0.69) APPKDM4EMEN1HPGDKMT2A
SCHEMBL3780738 0.92 APP (0.69) APPKDM4EMEN1HPGDKMT2A
SCHEMBL13636005 0.91 APP (0.64) APPKDM4EMEN1HPGDKMT2A
SCHEMBL14218033 0.85 APP (0.81) APPKDM4EMEN1HPGDKMT2A
SCHEMBL28924931 0.84 APP (0.84) APPKDM4EMEN1HPGDKMT2A
SCHEMBL4976275 0.83 APP (0.59) APPKDM4EMEN1HPGDKMT2A

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
EP-1421071-B1 SUBSTITUTED PIPERAZINE AND DIAZEPANE DERIVAIVES AS HISTAMINE H3 RECEPTOR MODULATORS HIGH POINT PHARMACEUTICALS LLC (US) 2009-11-18 EP claimed
EP-1421071-B1 SUBSTITUTED PIPERAZINE AND DIAZEPANE DERIVAIVES AS HISTAMINE H3 RECEPTOR MODULATORS HIGH POINT PHARMACEUTICALS LLC (US) 2009-11-18 EP disclosed
US-20080113968-A1 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2008-05-15 US disclosed
US-7208497-B2 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2007-04-24 US 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-20080113968-A1 Substituted piperazines and diazepanes HRH3, HRH4, HRH1 APP 892/4885KDM4E 1567/4885MEN1 2570/4885

“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.