SCHEMBL4382883

SCHEMBL4382883

O=C(CCCCC1CCCCC1)N1CCN(C2CCCCC2)CC1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ HSD11B1 P28845 1/20 0.52
▸ ALDH1A1 P00352 3/20 0.51
▸ TP53 P04637 1/20 0.51
▸ ATM Q13315 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ HIF1A Q16665 1/20 0.51
▸ SIGMAR1 Q99720 1/20 0.50
▸ NAAA Q02083 1/20 0.50
▸ HRH3 Q9Y5N1 4/20 0.49
▸ TSHR P16473 1/20 0.48

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
SCHEMBL4382097 1.00 KMT2A (0.59) KMT2AMEN1HSD11B1ALDH1A1TP53
SCHEMBL12128801 0.90 MEN1 (0.74) KMT2AMEN1HSD11B1ALDH1A1TP53
SCHEMBL2828741 0.90 MEN1 (0.74) KMT2AMEN1HSD11B1ALDH1A1TP53
SCHEMBL7371370 0.85 ATM (0.59) KMT2AMEN1HSD11B1ALDH1A1TP53
SCHEMBL22940447 0.85 ATM (0.59) KMT2AMEN1HSD11B1ALDH1A1TP53
SCHEMBL4075003 0.81 ALDH1A1 (0.52) KMT2AMEN1ALDH1A1ATMKDM4E
SCHEMBL14218032 0.81 HSD11B1 (0.81) KMT2AMEN1HSD11B1ALDH1A1TP53
SCHEMBL25447312 0.80 HSD11B1 (0.57) KMT2AMEN1HSD11B1ALDH1A1TP53
SCHEMBL24802123 0.78 GNAI3 (0.58) KMT2AMEN1HSD11B1ALDH1A1ATM
SCHEMBL8229259 0.78 ALDH1A1 (0.56) KMT2AMEN1HSD11B1ALDH1A1KDM4E

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 7 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-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 KMT2A 295/4885MEN1 2570/4885HSD11B1 2071/4885

“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.

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