SCHEMBL4378341

SCHEMBL4378341

O=C(COc1ccccc1Cl)N1CCN(c2ccncc2)CC1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.76
ALDH1A1 P00352 6/20 0.74
KDM4E B2RXH2 4/20 0.74
L3MBTL1 Q9Y468 1/20 0.74
MEN1 O00255 3/20 0.66
KMT2A Q03164 3/20 0.66
POLB P06746 1/20 0.64
TSHR P16473 1/20 0.64
TP53 P04637 2/20 0.59
LMNA P02545 5/20 0.59
MAPT P10636 4/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
NPSR1 Q6W5P4 3/20 0.57
HSD17B10 Q99714 1/20 0.57
GAA P10253 2/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
USP2 O75604 1/20 0.55

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
SCHEMBL4382063 0.91 HTT (0.63) HTTALDH1A1KDM4EL3MBTL1MEN1
SCHEMBL27979631 0.85 MEN1 (0.88) HTTALDH1A1KDM4EL3MBTL1MEN1
SCHEMBL4375414 0.85 TSHR (0.70) HTTALDH1A1KDM4EL3MBTL1MEN1
SCHEMBL4378529 0.83 ALDH1A1 (0.62) HTTALDH1A1KDM4EL3MBTL1KMT2A
SCHEMBL4379063 0.83 KDM4E (0.82) HTTALDH1A1KDM4EL3MBTL1TSHR
Hydrochloric Acid SCHEMBL4382890 0.82 ALDH1A1 (0.61) HTTALDH1A1KDM4EL3MBTL1KMT2A
SCHEMBL4379305 0.81 KMT2A (0.65) HTTALDH1A1KDM4EMEN1KMT2A
SCHEMBL2626276 0.81 HTT (0.59) HTTALDH1A1KDM4EL3MBTL1MEN1
SCHEMBL4386045 0.79 ALDH1A1 (0.60) HTTALDH1A1KDM4EL3MBTL1MEN1
SCHEMBL4379155 0.78 ENPP2 (0.67) HTTALDH1A1MEN1KMT2ATP53

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 9 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
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-20080113968-A1 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2008-05-15 US 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
US-7208497-B2 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2007-04-24 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 HTT 360/4885ALDH1A1 1907/4885KDM4E 1567/4885

“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.