SCHEMBL4384264

SCHEMBL4384264

O=C(C=CN1CCN(C2CCCCC2)CC1)c1cccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.52
KDM4E B2RXH2 4/20 0.49
ALDH1A1 P00352 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HIF1A Q16665 1/20 0.49
SIGMAR1 Q99720 4/20 0.46
POLB P06746 2/20 0.43
ACACB O00763 2/20 0.43
ACACA Q13085 2/20 0.43
LMNA P02545 2/20 0.43
KCNH2 Q12809 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
GPR52 Q9Y2T5 1/20 0.41
KDM2B Q8NHM5 1/20 0.41

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
SCHEMBL4378574 0.99 GAA (0.53) GAAKDM4EALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL4376221 0.98 GAA (0.52) GAAKDM4EALDH1A1MEN1KMT2A
SCHEMBL2833287 0.90 GAA (0.52) GAAKDM4EALDH1A1MEN1KMT2A
SCHEMBL2829562 0.89 GAA (0.53) GAAKDM4EALDH1A1MEN1KMT2A
SCHEMBL4382981 0.77 GAA (0.53) GAAKDM4EALDH1A1MEN1KMT2A
SCHEMBL4377273 0.76 GPR52 (0.44) GAAKDM4EALDH1A1MEN1KMT2A
SCHEMBL4378514 0.74 GPR52 (0.45) KDM4EALDH1A1MEN1KMT2ALMNA
SCHEMBL4375430 0.74 HRH3 (0.48) GAAKDM4EALDH1A1MEN1KMT2A
SCHEMBL4375865 0.73 ALDH1A1 (0.50) KDM4EALDH1A1MEN1KMT2AHIF1A
SCHEMBL4377900 0.72 HRH3 (0.52) MEN1KMT2AHRH3GPR52

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 GAA 2830/4885KDM4E 1567/4885ALDH1A1 1907/4885

“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.